N-(cyclohexylmethyl)imidazole-1-carboxamide

C11H17N3O — CID 43371648

IUPACN-(cyclohexylmethyl)imidazole-1-carboxamide
SMILESO=C(NCC1CCCCC1)n1ccnc1
InChIInChI=1S/C11H17N3O/c15-11(14-7-6-12-9-14)13-8-10-4-2-1-3-5-10/h6-7,9-10H,1-5,8H2,(H,13,15)
InChIKeyFQLXGOVRRVUBGY-UHFFFAOYSA-N
MW207.28 g/mol
LogP2.02
Rot. Bonds2

About N-(cyclohexylmethyl)imidazole-1-carboxamide

N-(cyclohexylmethyl)imidazole-1-carboxamide (PubChem CID 43371648) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is N-(cyclohexylmethyl)imidazole-1-carboxamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)imidazole-1-carboxamide
PubChem CID43371648
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC NameN-(cyclohexylmethyl)imidazole-1-carboxamide
SMILESO=C(NCC1CCCCC1)n1ccnc1
InChIInChI=1S/C11H17N3O/c15-11(14-7-6-12-9-14)13-8-10-4-2-1-3-5-10/h6-7,9-10H,1-5,8H2,(H,13,15)
InChIKeyFQLXGOVRRVUBGY-UHFFFAOYSA-N
XLogP2.02
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)imidazole-1-carboxamide?
The IUPAC name of N-(cyclohexylmethyl)imidazole-1-carboxamide (CID 43371648) is N-(cyclohexylmethyl)imidazole-1-carboxamide.
What is the SMILES notation for N-(cyclohexylmethyl)imidazole-1-carboxamide?
The canonical SMILES for N-(cyclohexylmethyl)imidazole-1-carboxamide is O=C(NCC1CCCCC1)n1ccnc1.
What is the InChIKey of N-(cyclohexylmethyl)imidazole-1-carboxamide?
The InChIKey is FQLXGOVRRVUBGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c15-11(14-7-6-12-9-14)13-8-10-4-2-1-3-5-10/h6-7,9-10H,1-5,8H2,(H,13,15).
What are the key properties of N-(cyclohexylmethyl)imidazole-1-carboxamide?
N-(cyclohexylmethyl)imidazole-1-carboxamide has a molecular weight of 207.28 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)imidazole-1-carboxamide is sourced from PubChem (CID 43371648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).