4-(propylamino)piperidine-4-carboxamide

C9H19N3O — CID 3024604

IUPAC4-(propylamino)piperidine-4-carboxamide
SMILESCCCNC1(C(N)=O)CCNCC1
InChIInChI=1S/C9H19N3O/c1-2-5-12-9(8(10)13)3-6-11-7-4-9/h11-12H,2-7H2,1H3,(H2,10,13)
InChIKeyKZMRRQMCXODLGO-UHFFFAOYSA-N
MW185.27 g/mol
LogP-0.41
Rot. Bonds4

About 4-(propylamino)piperidine-4-carboxamide

4-(propylamino)piperidine-4-carboxamide (PubChem CID 3024604) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is 4-(propylamino)piperidine-4-carboxamide.

Molecular Properties

Compound Name4-(propylamino)piperidine-4-carboxamide
PubChem CID3024604
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC Name4-(propylamino)piperidine-4-carboxamide
SMILESCCCNC1(C(N)=O)CCNCC1
InChIInChI=1S/C9H19N3O/c1-2-5-12-9(8(10)13)3-6-11-7-4-9/h11-12H,2-7H2,1H3,(H2,10,13)
InChIKeyKZMRRQMCXODLGO-UHFFFAOYSA-N
XLogP-0.41
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 5-0.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(propylamino)piperidine-4-carboxamide?
The IUPAC name of 4-(propylamino)piperidine-4-carboxamide (CID 3024604) is 4-(propylamino)piperidine-4-carboxamide.
What is the SMILES notation for 4-(propylamino)piperidine-4-carboxamide?
The canonical SMILES for 4-(propylamino)piperidine-4-carboxamide is CCCNC1(C(N)=O)CCNCC1.
What is the InChIKey of 4-(propylamino)piperidine-4-carboxamide?
The InChIKey is KZMRRQMCXODLGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-2-5-12-9(8(10)13)3-6-11-7-4-9/h11-12H,2-7H2,1H3,(H2,10,13).
What are the key properties of 4-(propylamino)piperidine-4-carboxamide?
4-(propylamino)piperidine-4-carboxamide has a molecular weight of 185.27 g/mol, XLogP of -0.41, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(propylamino)piperidine-4-carboxamide is sourced from PubChem (CID 3024604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).