N-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide

C27H52N4O2 — CID 59202476

IUPACN-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide
SMILESCN1C(C)(C)CC(N(C=O)CCCCCN(C=O)C2CC(C)(C)N(C)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C27H52N4O2/c1-24(2)16-22(17-25(3,4)28(24)9)30(20-32)14-12-11-13-15-31(21-33)23-18-26(5,6)29(10)27(7,8)19-23/h20-23H,11-19H2,1-10H3
InChIKeyJIUWMAXQCBBPSP-UHFFFAOYSA-N
MW464.74 g/mol
LogP4.38
Rot. Bonds10

About N-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide

N-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide (PubChem CID 59202476) has the molecular formula C27H52N4O2 and a molecular weight of 464.74 g/mol. Its IUPAC name is N-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide.

Molecular Properties

Compound NameN-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide
PubChem CID59202476
Molecular FormulaC27H52N4O2
Molecular Weight464.74 g/mol
Exact Mass464.41
IUPAC NameN-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide
SMILESCN1C(C)(C)CC(N(C=O)CCCCCN(C=O)C2CC(C)(C)N(C)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C27H52N4O2/c1-24(2)16-22(17-25(3,4)28(24)9)30(20-32)14-12-11-13-15-31(21-33)23-18-26(5,6)29(10)27(7,8)19-23/h20-23H,11-19H2,1-10H3
InChIKeyJIUWMAXQCBBPSP-UHFFFAOYSA-N
XLogP4.38
TPSA47.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.74
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide?
The IUPAC name of N-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide (CID 59202476) is N-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide.
What is the SMILES notation for N-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide?
The canonical SMILES for N-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide is CN1C(C)(C)CC(N(C=O)CCCCCN(C=O)C2CC(C)(C)N(C)C(C)(C)C2)CC1(C)C.
What is the InChIKey of N-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide?
The InChIKey is JIUWMAXQCBBPSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H52N4O2/c1-24(2)16-22(17-25(3,4)28(24)9)30(20-32)14-12-11-13-15-31(21-33)23-18-26(5,6)29(10)27(7,8)19-23/h20-23H,11-19H2,1-10H3.
What are the key properties of N-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide?
N-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide has a molecular weight of 464.74 g/mol, XLogP of 4.38, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]pentyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide is sourced from PubChem (CID 59202476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).