1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide

C14H22N4O — CID 80754030

IUPAC1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide
SMILESCCCNc1cccc(N2CCC(C(N)=O)CC2)n1
InChIInChI=1S/C14H22N4O/c1-2-8-16-12-4-3-5-13(17-12)18-9-6-11(7-10-18)14(15)19/h3-5,11H,2,6-10H2,1H3,(H2,15,19)(H,16,17)
InChIKeySZJNRZSQMGFPQQ-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.61
Rot. Bonds5

About 1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide

1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide (PubChem CID 80754030) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide
PubChem CID80754030
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide
SMILESCCCNc1cccc(N2CCC(C(N)=O)CC2)n1
InChIInChI=1S/C14H22N4O/c1-2-8-16-12-4-3-5-13(17-12)18-9-6-11(7-10-18)14(15)19/h3-5,11H,2,6-10H2,1H3,(H2,15,19)(H,16,17)
InChIKeySZJNRZSQMGFPQQ-UHFFFAOYSA-N
XLogP1.61
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide?
The IUPAC name of 1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide (CID 80754030) is 1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide is CCCNc1cccc(N2CCC(C(N)=O)CC2)n1.
What is the InChIKey of 1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide?
The InChIKey is SZJNRZSQMGFPQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-2-8-16-12-4-3-5-13(17-12)18-9-6-11(7-10-18)14(15)19/h3-5,11H,2,6-10H2,1H3,(H2,15,19)(H,16,17).
What are the key properties of 1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide?
1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide has a molecular weight of 262.36 g/mol, XLogP of 1.61, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(propylamino)-2-pyridinyl]piperidine-4-carboxamide is sourced from PubChem (CID 80754030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).