4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one

C14H26N2O — CID 114155313

IUPAC4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one
SMILESCCCC1CCCC(NC2CNC(=O)C2)CC1
InChIInChI=1S/C14H26N2O/c1-2-4-11-5-3-6-12(8-7-11)16-13-9-14(17)15-10-13/h11-13,16H,2-10H2,1H3,(H,15,17)
InChIKeyOLZPLIAXSSBVNC-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.21
Rot. Bonds4

About 4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one

4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one (PubChem CID 114155313) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one.

Molecular Properties

Compound Name4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one
PubChem CID114155313
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one
SMILESCCCC1CCCC(NC2CNC(=O)C2)CC1
InChIInChI=1S/C14H26N2O/c1-2-4-11-5-3-6-12(8-7-11)16-13-9-14(17)15-10-13/h11-13,16H,2-10H2,1H3,(H,15,17)
InChIKeyOLZPLIAXSSBVNC-UHFFFAOYSA-N
XLogP2.21
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclobutyl-4-propylcycloheptan-1-amine
CID 65091278
4-(2-cyclopropylethylamino)pyrrolidin-2-one
CID 106189081
4-propan-2-yl-N-(4-propylcyclohexyl)cycloheptan-1-amine
CID 65091606
4-(piperidin-4-ylamino)pyrrolidin-2-one
CID 106184253
N-(2,2-dimethylpropyl)-4-propylcycloheptan-1-amine
CID 65091749
1-butyl-N-(4-propylcycloheptyl)piperidin-4-amine
CID 65091542
4-[(4-tert-butylcyclohexyl)methylamino]pyrrolidin-2-one
CID 104665410
4-(4-propylazepane-1-carbonyl)pyrrolidin-2-one
CID 49007468
N-(4-propylcycloheptyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 65091204
4-[[2-(aminomethyl)cyclopentyl]amino]pyrrolidin-2-one
CID 106184314
N-(2,2-dimethylcyclopentyl)-4-propylcycloheptan-1-amine
CID 79862133
N-[(4S)-2-oxoazepan-4-yl]-4-pentylcyclohexane-1-sulfonamide
CID 140556941

Frequently Asked Questions

What is the IUPAC name of 4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one?
The IUPAC name of 4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one (CID 114155313) is 4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one.
What is the SMILES notation for 4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one?
The canonical SMILES for 4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one is CCCC1CCCC(NC2CNC(=O)C2)CC1.
What is the InChIKey of 4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one?
The InChIKey is OLZPLIAXSSBVNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-2-4-11-5-3-6-12(8-7-11)16-13-9-14(17)15-10-13/h11-13,16H,2-10H2,1H3,(H,15,17).
What are the key properties of 4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one?
4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one has a molecular weight of 238.37 g/mol, XLogP of 2.21, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-propylcycloheptyl)amino]pyrrolidin-2-one is sourced from PubChem (CID 114155313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).