(3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide

C9H14N4O — CID 81139688

IUPAC(3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide
SMILESO=C(Nc1ncc[nH]1)[C@@H]1CCCNC1
InChIInChI=1S/C9H14N4O/c14-8(7-2-1-3-10-6-7)13-9-11-4-5-12-9/h4-5,7,10H,1-3,6H2,(H2,11,12,13,14)/t7-/m1/s1
InChIKeyGUEUIGYGDWGHFV-SSDOTTSWSA-N
MW194.24 g/mol
LogP0.35
Rot. Bonds2

About (3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide

(3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide (PubChem CID 81139688) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is (3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide
PubChem CID81139688
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC Name(3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide
SMILESO=C(Nc1ncc[nH]1)[C@@H]1CCCNC1
InChIInChI=1S/C9H14N4O/c14-8(7-2-1-3-10-6-7)13-9-11-4-5-12-9/h4-5,7,10H,1-3,6H2,(H2,11,12,13,14)/t7-/m1/s1
InChIKeyGUEUIGYGDWGHFV-SSDOTTSWSA-N
XLogP0.35
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 50.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide (CID 81139688) is (3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide is O=C(Nc1ncc[nH]1)[C@@H]1CCCNC1.
What is the InChIKey of (3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide?
The InChIKey is GUEUIGYGDWGHFV-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H14N4O/c14-8(7-2-1-3-10-6-7)13-9-11-4-5-12-9/h4-5,7,10H,1-3,6H2,(H2,11,12,13,14)/t7-/m1/s1.
What are the key properties of (3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide?
(3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide has a molecular weight of 194.24 g/mol, XLogP of 0.35, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide is sourced from PubChem (CID 81139688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).