1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide

C16H30N2O — CID 114793919

IUPAC1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide
SMILESCC(C)CC1(C(=O)NCCC2CCCN2)CCCC1
InChIInChI=1S/C16H30N2O/c1-13(2)12-16(8-3-4-9-16)15(19)18-11-7-14-6-5-10-17-14/h13-14,17H,3-12H2,1-2H3,(H,18,19)
InChIKeyUJXJDVZGQVOWMV-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.85
Rot. Bonds6

About 1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide

1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide (PubChem CID 114793919) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide
PubChem CID114793919
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide
SMILESCC(C)CC1(C(=O)NCCC2CCCN2)CCCC1
InChIInChI=1S/C16H30N2O/c1-13(2)12-16(8-3-4-9-16)15(19)18-11-7-14-6-5-10-17-14/h13-14,17H,3-12H2,1-2H3,(H,18,19)
InChIKeyUJXJDVZGQVOWMV-UHFFFAOYSA-N
XLogP2.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide
CID 83619295
2-methoxy-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]propanamide
CID 104955350
2-ethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]butanamide
CID 104972087
1-ethyl-3-[2-[(2R)-pyrrolidin-2-yl]ethyl]urea
CID 104972281
N-[2-[(2S)-pyrrolidin-2-yl]ethyl]propanamide
CID 104955188
2,2-dimethyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]cyclopropane-1-carboxamide
CID 104954995
N-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 107322176
3-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]adamantane-1-carboxamide
CID 104972040
3-methyl-N-(2-pyrrolidin-2-ylethyl)adamantane-1-carboxamide
CID 114793932
N-[3-(methylamino)propyl]-1-(2-methylpropyl)cyclobutane-1-carboxamide;hydrochloride
CID 119430611
N-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide
CID 104955184
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]cyclopentanecarboxamide
CID 104972065

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide (CID 114793919) is 1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide is CC(C)CC1(C(=O)NCCC2CCCN2)CCCC1.
What is the InChIKey of 1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide?
The InChIKey is UJXJDVZGQVOWMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-13(2)12-16(8-3-4-9-16)15(19)18-11-7-14-6-5-10-17-14/h13-14,17H,3-12H2,1-2H3,(H,18,19).
What are the key properties of 1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide?
1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide has a molecular weight of 266.43 g/mol, XLogP of 2.85, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 114793919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).