1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one

C13H24N2O — CID 64918845

IUPAC1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one
SMILESCCC(NC(C)CN1CCCC1=O)C1CC1
InChIInChI=1S/C13H24N2O/c1-3-12(11-6-7-11)14-10(2)9-15-8-4-5-13(15)16/h10-12,14H,3-9H2,1-2H3
InChIKeyMIVNDGYIRHSMPX-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.78
Rot. Bonds6

About 1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one

1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one (PubChem CID 64918845) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one
PubChem CID64918845
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one
SMILESCCC(NC(C)CN1CCCC1=O)C1CC1
InChIInChI=1S/C13H24N2O/c1-3-12(11-6-7-11)14-10(2)9-15-8-4-5-13(15)16/h10-12,14H,3-9H2,1-2H3
InChIKeyMIVNDGYIRHSMPX-UHFFFAOYSA-N
XLogP1.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-[1-(1-ethylpiperidin-3-yl)ethylamino]propyl]pyrrolidin-2-one
CID 60932602
1-[2-[(1-ethylpiperidin-4-yl)amino]propyl]pyrrolidin-2-one
CID 54865964
1-[2-[(4-methylcyclohexyl)amino]propyl]pyrrolidin-2-one
CID 54865939
1-[2-[(4-methoxy-4-methylpentan-2-yl)amino]propyl]pyrrolidin-2-one
CID 54865922
1-[2-cyclopentyl-2-(methylamino)ethyl]azocan-2-one
CID 104747242
1-[2-[1-(4-bromophenyl)propylamino]propyl]pyrrolidin-2-one
CID 60931846
1-[2-[(3-methoxy-3-methylbutan-2-yl)amino]propyl]pyrrolidin-2-one
CID 114228203
1-[2-[(4-tert-butylcyclohexyl)amino]propyl]pyrrolidin-2-one
CID 60935140
1-[2-[(2-propan-2-ylcyclohexyl)amino]propyl]pyrrolidin-2-one
CID 81329280
1-[2-[(1,1-dioxothian-4-yl)amino]propyl]pyrrolidin-2-one
CID 54865825
1-[2-[[1-(2-methylpropyl)piperidin-4-yl]amino]propyl]pyrrolidin-2-one
CID 103778451
1-[2-[(1-oxothian-4-yl)amino]propyl]pyrrolidin-2-one
CID 54981585

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one?
The IUPAC name of 1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one (CID 64918845) is 1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one?
The canonical SMILES for 1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one is CCC(NC(C)CN1CCCC1=O)C1CC1.
What is the InChIKey of 1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one?
The InChIKey is MIVNDGYIRHSMPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-3-12(11-6-7-11)14-10(2)9-15-8-4-5-13(15)16/h10-12,14H,3-9H2,1-2H3.
What are the key properties of 1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one?
1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one has a molecular weight of 224.35 g/mol, XLogP of 1.78, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-cyclopropylpropylamino)propyl]pyrrolidin-2-one is sourced from PubChem (CID 64918845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).