N-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide

C24H46N4O2 — CID 10477358

IUPACN-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide
SMILESCN(CCCCCCN(C)C(=O)CCN1CCCCC1)C(=O)CCN1CCCCC1
InChIInChI=1S/C24H46N4O2/c1-25(23(29)13-21-27-17-9-5-10-18-27)15-7-3-4-8-16-26(2)24(30)14-22-28-19-11-6-12-20-28/h3-22H2,1-2H3
InChIKeyQCHVOAZFILYDSI-UHFFFAOYSA-N
MW422.66 g/mol
LogP3.22
Rot. Bonds13

About N-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide

N-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide (PubChem CID 10477358) has the molecular formula C24H46N4O2 and a molecular weight of 422.66 g/mol. Its IUPAC name is N-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide.

Molecular Properties

Compound NameN-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide
PubChem CID10477358
Molecular FormulaC24H46N4O2
Molecular Weight422.66 g/mol
Exact Mass422.36
IUPAC NameN-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide
SMILESCN(CCCCCCN(C)C(=O)CCN1CCCCC1)C(=O)CCN1CCCCC1
InChIInChI=1S/C24H46N4O2/c1-25(23(29)13-21-27-17-9-5-10-18-27)15-7-3-4-8-16-26(2)24(30)14-22-28-19-11-6-12-20-28/h3-22H2,1-2H3
InChIKeyQCHVOAZFILYDSI-UHFFFAOYSA-N
XLogP3.22
TPSA47.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.66
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

7-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)heptanamide
CID 63207884
N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide
CID 63239691
4-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide
CID 63207232
methyl N-methyl-N-(6-piperidin-1-ylhexyl)carbamate
CID 110459514
6-[methyl(2-pyrrolidin-1-ylethyl)amino]-6-oxohexanoic acid
CID 63207758
N-butyl-3-(4-ethylpiperazin-1-yl)-N-methylpropanamide
CID 109017680
N-(3-aminopropyl)-3-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-N-methylpropanamide
CID 62884866
(E)-N-methyl-N-(6-piperidin-1-ylhexyl)but-2-enamide
CID 110459787
5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide
CID 82851299
N-(3-aminopropyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)-N-methylpropanamide
CID 43581216
N,N-diethyl-3-piperidin-1-ylpropanamide
CID 110688324
N-(3-aminopropyl)-2-(azepan-1-yl)-N-methylacetamide
CID 43253394

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide?
The IUPAC name of N-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide (CID 10477358) is N-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide.
What is the SMILES notation for N-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide?
The canonical SMILES for N-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide is CN(CCCCCCN(C)C(=O)CCN1CCCCC1)C(=O)CCN1CCCCC1.
What is the InChIKey of N-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide?
The InChIKey is QCHVOAZFILYDSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H46N4O2/c1-25(23(29)13-21-27-17-9-5-10-18-27)15-7-3-4-8-16-26(2)24(30)14-22-28-19-11-6-12-20-28/h3-22H2,1-2H3.
What are the key properties of N-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide?
N-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide has a molecular weight of 422.66 g/mol, XLogP of 3.22, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide is sourced from PubChem (CID 10477358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).