4-(1-phenylpentylamino)pyrrolidin-2-one

C15H22N2O — CID 106183225

IUPAC4-(1-phenylpentylamino)pyrrolidin-2-one
SMILESCCCCC(NC1CNC(=O)C1)c1ccccc1
InChIInChI=1S/C15H22N2O/c1-2-3-9-14(12-7-5-4-6-8-12)17-13-10-15(18)16-11-13/h4-8,13-14,17H,2-3,9-11H2,1H3,(H,16,18)
InChIKeyQBBPIHBUNSFLJW-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.40
Rot. Bonds6

About 4-(1-phenylpentylamino)pyrrolidin-2-one

4-(1-phenylpentylamino)pyrrolidin-2-one (PubChem CID 106183225) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 4-(1-phenylpentylamino)pyrrolidin-2-one.

Molecular Properties

Compound Name4-(1-phenylpentylamino)pyrrolidin-2-one
PubChem CID106183225
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name4-(1-phenylpentylamino)pyrrolidin-2-one
SMILESCCCCC(NC1CNC(=O)C1)c1ccccc1
InChIInChI=1S/C15H22N2O/c1-2-3-9-14(12-7-5-4-6-8-12)17-13-10-15(18)16-11-13/h4-8,13-14,17H,2-3,9-11H2,1H3,(H,16,18)
InChIKeyQBBPIHBUNSFLJW-UHFFFAOYSA-N
XLogP2.40
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-(1-phenylpropylamino)piperidin-2-one
CID 63661190
4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine
CID 43761510
N-(1-phenylpentyl)cycloheptanamine
CID 43767069
4-N-(1-phenylpentyl)cyclohexane-1,4-diamine
CID 62319614
5-[(3,3,3-trifluoro-1-phenylpropyl)amino]piperidin-2-one
CID 63661532
4-[1-(2-methoxyphenyl)propylamino]pyrrolidin-2-one
CID 114155090
5-[1-(3-nitrophenyl)butylamino]piperidin-2-one
CID 63663334
3-[(5-oxopyrrolidin-3-yl)carbamoylamino]-3-phenylpropanoic acid
CID 106191844
(4S)-4-[(1S)-1-phenylpropyl]pyrrolidin-2-one
CID 124705684
4-(1-phenylpropyl)pyrrolidin-2-one
CID 122156868
3-amino-N-(5-oxopyrrolidin-3-yl)-2-phenylpropanamide
CID 106186177
(1S)-N-methyl-1-phenylpentan-1-amine
CID 86314170

Frequently Asked Questions

What is the IUPAC name of 4-(1-phenylpentylamino)pyrrolidin-2-one?
The IUPAC name of 4-(1-phenylpentylamino)pyrrolidin-2-one (CID 106183225) is 4-(1-phenylpentylamino)pyrrolidin-2-one.
What is the SMILES notation for 4-(1-phenylpentylamino)pyrrolidin-2-one?
The canonical SMILES for 4-(1-phenylpentylamino)pyrrolidin-2-one is CCCCC(NC1CNC(=O)C1)c1ccccc1.
What is the InChIKey of 4-(1-phenylpentylamino)pyrrolidin-2-one?
The InChIKey is QBBPIHBUNSFLJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-2-3-9-14(12-7-5-4-6-8-12)17-13-10-15(18)16-11-13/h4-8,13-14,17H,2-3,9-11H2,1H3,(H,16,18).
What are the key properties of 4-(1-phenylpentylamino)pyrrolidin-2-one?
4-(1-phenylpentylamino)pyrrolidin-2-one has a molecular weight of 246.35 g/mol, XLogP of 2.40, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-phenylpentylamino)pyrrolidin-2-one is sourced from PubChem (CID 106183225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).