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

C27H52N4O2 — CID 59873148

IUPACN-[6-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide
SMILESCN1C(C)(C)CC(N(C=O)CCCCCCN(C=O)C2CC(C)(C)NC(C)(C)C2)CC1(C)C
InChIInChI=1S/C27H52N4O2/c1-24(2)16-22(17-25(3,4)28-24)30(20-32)14-12-10-11-13-15-31(21-33)23-18-26(5,6)29(9)27(7,8)19-23/h20-23,28H,10-19H2,1-9H3
InChIKeyXACOWSLVANBBEH-UHFFFAOYSA-N
MW464.74 g/mol
LogP4.42
Rot. Bonds11

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

N-[6-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide (PubChem CID 59873148) has the molecular formula C27H52N4O2 and a molecular weight of 464.74 g/mol. Its IUPAC name is N-[6-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide.

Molecular Properties

Compound NameN-[6-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide
PubChem CID59873148
Molecular FormulaC27H52N4O2
Molecular Weight464.74 g/mol
Exact Mass464.41
IUPAC NameN-[6-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide
SMILESCN1C(C)(C)CC(N(C=O)CCCCCCN(C=O)C2CC(C)(C)NC(C)(C)C2)CC1(C)C
InChIInChI=1S/C27H52N4O2/c1-24(2)16-22(17-25(3,4)28-24)30(20-32)14-12-10-11-13-15-31(21-33)23-18-26(5,6)29(9)27(7,8)19-23/h20-23,28H,10-19H2,1-9H3
InChIKeyXACOWSLVANBBEH-UHFFFAOYSA-N
XLogP4.42
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.74
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Formamide, N,N'-1,6-hexanediylbis(N-(2,2,6,6-tetramethyl-4-piperidinyl)-
CID 14419064
1,3-Bis(2,2,6,6-tetramethyl-4-piperidyl)urea
CID 118165
4-(N-cyclohexyl-N-formylamino)-2,2,6,6-tetramethylpiperidine
CID 14419060
4,4a(2)-[1,6-Hexanediylbis(formylimino)]bis[2,2,6,6-tetramethyl-1-piperidinyloxy]
CID 11070880
N,N'-Bis(1-oxyl-2,2,6,6-tetramethylpiperidin-4-yl)-N,N'-bis-formyl-1,6-diaminohexane
CID 87152024
N-[6-[acetyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
CID 21838395
3-[methyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanamide
CID 1250923
2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide
CID 11070846
methyl N-[6-[methoxycarbonyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)carbamate
CID 11113943
N-[6-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)formamide
CID 11271554
N-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide
CID 14419057
4-(N-formyl-N-octylamino)-2,2,6,6-tetramethylpiperidine
CID 14419058

Frequently Asked Questions

What is the IUPAC name of N-[6-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
The IUPAC name of N-[6-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide (CID 59873148) is N-[6-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide.
What is the SMILES notation for N-[6-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
The canonical SMILES for N-[6-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide is CN1C(C)(C)CC(N(C=O)CCCCCCN(C=O)C2CC(C)(C)NC(C)(C)C2)CC1(C)C.
What is the InChIKey of N-[6-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
The InChIKey is XACOWSLVANBBEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H52N4O2/c1-24(2)16-22(17-25(3,4)28-24)30(20-32)14-12-10-11-13-15-31(21-33)23-18-26(5,6)29(9)27(7,8)19-23/h20-23,28H,10-19H2,1-9H3.
What are the key properties of N-[6-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
N-[6-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide has a molecular weight of 464.74 g/mol, XLogP of 4.42, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[formyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide is sourced from PubChem (CID 59873148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).