1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one

C10H20N2O — CID 60935632

IUPAC1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one
SMILESCC(C)NC(C)CN1CCCC1=O
InChIInChI=1S/C10H20N2O/c1-8(2)11-9(3)7-12-6-4-5-10(12)13/h8-9,11H,4-7H2,1-3H3
InChIKeyLRVHBVCLGNMWDK-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.00
Rot. Bonds4

About 1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one

1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one (PubChem CID 60935632) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one
PubChem CID60935632
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one
SMILESCC(C)NC(C)CN1CCCC1=O
InChIInChI=1S/C10H20N2O/c1-8(2)11-9(3)7-12-6-4-5-10(12)13/h8-9,11H,4-7H2,1-3H3
InChIKeyLRVHBVCLGNMWDK-UHFFFAOYSA-N
XLogP1.00
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one?
The IUPAC name of 1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one (CID 60935632) is 1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one?
The canonical SMILES for 1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one is CC(C)NC(C)CN1CCCC1=O.
What is the InChIKey of 1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one?
The InChIKey is LRVHBVCLGNMWDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-8(2)11-9(3)7-12-6-4-5-10(12)13/h8-9,11H,4-7H2,1-3H3.
What are the key properties of 1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one?
1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one has a molecular weight of 184.28 g/mol, XLogP of 1.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(propan-2-ylamino)propyl]pyrrolidin-2-one is sourced from PubChem (CID 60935632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).