N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide

C18H34N2O2 — CID 119812115

IUPACN-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide
SMILESCOCCC1(CNC(=O)CC(C)C2CCCNC2)CCCC1
InChIInChI=1S/C18H34N2O2/c1-15(16-6-5-10-19-13-16)12-17(21)20-14-18(9-11-22-2)7-3-4-8-18/h15-16,19H,3-14H2,1-2H3,(H,20,21)
InChIKeySAOVJLNUZUBPIL-UHFFFAOYSA-N
MW310.48 g/mol
LogP2.73
Rot. Bonds8

About N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide

N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide (PubChem CID 119812115) has the molecular formula C18H34N2O2 and a molecular weight of 310.48 g/mol. Its IUPAC name is N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide.

Molecular Properties

Compound NameN-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide
PubChem CID119812115
Molecular FormulaC18H34N2O2
Molecular Weight310.48 g/mol
Exact Mass310.26
IUPAC NameN-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide
SMILESCOCCC1(CNC(=O)CC(C)C2CCCNC2)CCCC1
InChIInChI=1S/C18H34N2O2/c1-15(16-6-5-10-19-13-16)12-17(21)20-14-18(9-11-22-2)7-3-4-8-18/h15-16,19H,3-14H2,1-2H3,(H,20,21)
InChIKeySAOVJLNUZUBPIL-UHFFFAOYSA-N
XLogP2.73
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.48
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(2-methoxyethyl)cyclobutyl]methyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119820386
N-[[1-(2-methylpropyl)cyclobutyl]methyl]-3-piperidin-3-ylbutanamide
CID 119788862
N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide;dihydrochloride
CID 119830098
N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]-3-piperidin-4-ylbutanamide
CID 119812192
N-(cyanomethyl)-3-piperidin-3-ylbutanamide
CID 81044352
methyl 1-(3-piperidin-3-ylbutanoylamino)cycloheptane-1-carboxylate
CID 119704584
N-(2-methylbutyl)-3-piperidin-3-ylbutanamide
CID 81043770
N-(cyclobutylmethyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119724147
N-[(2-methyloxolan-2-yl)methyl]-3-piperidin-3-ylbutanamide;hydrochloride
CID 119782234
3-amino-N-[[1-(2-methoxyethyl)cyclobutyl]methyl]butanamide
CID 119820393
N-(2-ethoxypropyl)-3-piperidin-3-ylbutanamide
CID 115739458
N-butyl-3-piperidin-3-ylbutanamide;hydrochloride
CID 119671850

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide?
The IUPAC name of N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide (CID 119812115) is N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide.
What is the SMILES notation for N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide?
The canonical SMILES for N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide is COCCC1(CNC(=O)CC(C)C2CCCNC2)CCCC1.
What is the InChIKey of N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide?
The InChIKey is SAOVJLNUZUBPIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O2/c1-15(16-6-5-10-19-13-16)12-17(21)20-14-18(9-11-22-2)7-3-4-8-18/h15-16,19H,3-14H2,1-2H3,(H,20,21).
What are the key properties of N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide?
N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide has a molecular weight of 310.48 g/mol, XLogP of 2.73, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-3-piperidin-3-ylbutanamide is sourced from PubChem (CID 119812115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).