N-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide

C55H108N10O4 — CID 157342004

IUPACN-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
SMILESCC(=O)CNCCNCC(=O)N(CCCN(C)C1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1.CC1(C)CC(N(C=O)CCCCCCN(C=O)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1
InChIInChI=1S/C29H58N6O2.C26H50N4O2/c1-22(36)20-30-12-13-31-21-25(37)35(24-18-28(6,7)33-29(8,9)19-24)15-11-14-34(10)23-16-26(2,3)32-27(4,5)17-23;1-23(2)15-21(16-24(3,4)27-23)29(19-31)13-11-9-10-12-14-30(20-32)22-17-25(5,6)28-26(7,8)18-22/h23-24,30-33H,11-21H2,1-10H3;19-22,27-28H,9-18H2,1-8H3
InChIKeyBGMSZGORDUXEEC-UHFFFAOYSA-N
MW973.53 g/mol
LogP6.61
Rot. Bonds24

About N-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide

N-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide (PubChem CID 157342004) has the molecular formula C55H108N10O4 and a molecular weight of 973.53 g/mol. Its IUPAC name is N-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
PubChem CID157342004
Molecular FormulaC55H108N10O4
Molecular Weight973.53 g/mol
Exact Mass972.86
IUPAC NameN-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
SMILESCC(=O)CNCCNCC(=O)N(CCCN(C)C1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1.CC1(C)CC(N(C=O)CCCCCCN(C=O)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1
InChIInChI=1S/C29H58N6O2.C26H50N4O2/c1-22(36)20-30-12-13-31-21-25(37)35(24-18-28(6,7)33-29(8,9)19-24)15-11-14-34(10)23-16-26(2,3)32-27(4,5)17-23;1-23(2)15-21(16-24(3,4)27-23)29(19-31)13-11-9-10-12-14-30(20-32)22-17-25(5,6)28-26(7,8)18-22/h23-24,30-33H,11-21H2,1-10H3;19-22,27-28H,9-18H2,1-8H3
InChIKeyBGMSZGORDUXEEC-UHFFFAOYSA-N
XLogP6.61
TPSA153.42 Ų
H-Bond Donors6
H-Bond Acceptors11
Rotatable Bonds24
Heavy Atoms69
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 500973.53
LogP ≤ 56.61
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The IUPAC name of N-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide (CID 157342004) is N-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The canonical SMILES for N-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide is CC(=O)CNCCNCC(=O)N(CCCN(C)C1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1.CC1(C)CC(N(C=O)CCCCCCN(C=O)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1.
What is the InChIKey of N-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The InChIKey is BGMSZGORDUXEEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H58N6O2.C26H50N4O2/c1-22(36)20-30-12-13-31-21-25(37)35(24-18-28(6,7)33-29(8,9)19-24)15-11-14-34(10)23-16-26(2,3)32-27(4,5)17-23;1-23(2)15-21(16-24(3,4)27-23)29(19-31)13-11-9-10-12-14-30(20-32)22-17-25(5,6)28-26(7,8)18-22/h23-24,30-33H,11-21H2,1-10H3;19-22,27-28H,9-18H2,1-8H3.
What are the key properties of N-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
N-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide has a molecular weight of 973.53 g/mol, XLogP of 6.61, 24 rotatable bonds, 6 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide;N-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]-2-[2-(2-oxopropylamino)ethylamino]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide is sourced from PubChem (CID 157342004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).