1-(3-aminopropyl)piperidine-4-carboxamide

C9H19N3O — CID 16779053

IUPAC1-(3-aminopropyl)piperidine-4-carboxamide
SMILESNCCCN1CCC(C(N)=O)CC1
InChIInChI=1S/C9H19N3O/c10-4-1-5-12-6-2-8(3-7-12)9(11)13/h8H,1-7,10H2,(H2,11,13)
InChIKeySZYRASLRZWJIEC-UHFFFAOYSA-N
MW185.27 g/mol
LogP-0.47
Rot. Bonds4

About 1-(3-aminopropyl)piperidine-4-carboxamide

1-(3-aminopropyl)piperidine-4-carboxamide (PubChem CID 16779053) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is 1-(3-aminopropyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3-aminopropyl)piperidine-4-carboxamide
PubChem CID16779053
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC Name1-(3-aminopropyl)piperidine-4-carboxamide
SMILESNCCCN1CCC(C(N)=O)CC1
InChIInChI=1S/C9H19N3O/c10-4-1-5-12-6-2-8(3-7-12)9(11)13/h8H,1-7,10H2,(H2,11,13)
InChIKeySZYRASLRZWJIEC-UHFFFAOYSA-N
XLogP-0.47
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 5-0.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-aminopropyl)piperidine-4-carboxamide?
The IUPAC name of 1-(3-aminopropyl)piperidine-4-carboxamide (CID 16779053) is 1-(3-aminopropyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(3-aminopropyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(3-aminopropyl)piperidine-4-carboxamide is NCCCN1CCC(C(N)=O)CC1.
What is the InChIKey of 1-(3-aminopropyl)piperidine-4-carboxamide?
The InChIKey is SZYRASLRZWJIEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c10-4-1-5-12-6-2-8(3-7-12)9(11)13/h8H,1-7,10H2,(H2,11,13).
What are the key properties of 1-(3-aminopropyl)piperidine-4-carboxamide?
1-(3-aminopropyl)piperidine-4-carboxamide has a molecular weight of 185.27 g/mol, XLogP of -0.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-aminopropyl)piperidine-4-carboxamide is sourced from PubChem (CID 16779053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).