4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide

C15H24N4O2 — CID 71931015

IUPAC4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide
SMILESCN(CCCO)C1CCN(C(=O)Nc2ccccn2)CC1
InChIInChI=1S/C15H24N4O2/c1-18(9-4-12-20)13-6-10-19(11-7-13)15(21)17-14-5-2-3-8-16-14/h2-3,5,8,13,20H,4,6-7,9-12H2,1H3,(H,16,17,21)
InChIKeySOCDFNCYSCVOGX-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.39
Rot. Bonds5

About 4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide

4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide (PubChem CID 71931015) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide
PubChem CID71931015
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide
SMILESCN(CCCO)C1CCN(C(=O)Nc2ccccn2)CC1
InChIInChI=1S/C15H24N4O2/c1-18(9-4-12-20)13-6-10-19(11-7-13)15(21)17-14-5-2-3-8-16-14/h2-3,5,8,13,20H,4,6-7,9-12H2,1H3,(H,16,17,21)
InChIKeySOCDFNCYSCVOGX-UHFFFAOYSA-N
XLogP1.39
TPSA68.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide?
The IUPAC name of 4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide (CID 71931015) is 4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide.
What is the SMILES notation for 4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide?
The canonical SMILES for 4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide is CN(CCCO)C1CCN(C(=O)Nc2ccccn2)CC1.
What is the InChIKey of 4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide?
The InChIKey is SOCDFNCYSCVOGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-18(9-4-12-20)13-6-10-19(11-7-13)15(21)17-14-5-2-3-8-16-14/h2-3,5,8,13,20H,4,6-7,9-12H2,1H3,(H,16,17,21).
What are the key properties of 4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide?
4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.39, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-hydroxypropyl(methyl)amino]-N-pyridin-2-ylpiperidine-1-carboxamide is sourced from PubChem (CID 71931015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).