N-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide

C14H17N5O — CID 121112570

IUPACN-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide
SMILESO=C(Nc1cnc(-n2ccnc2)nc1)C1CCCCC1
InChIInChI=1S/C14H17N5O/c20-13(11-4-2-1-3-5-11)18-12-8-16-14(17-9-12)19-7-6-15-10-19/h6-11H,1-5H2,(H,18,20)
InChIKeyNAWYHGPOBURNGW-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.18
Rot. Bonds3

About N-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide

N-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide (PubChem CID 121112570) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide.

Molecular Properties

Compound NameN-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide
PubChem CID121112570
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC NameN-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide
SMILESO=C(Nc1cnc(-n2ccnc2)nc1)C1CCCCC1
InChIInChI=1S/C14H17N5O/c20-13(11-4-2-1-3-5-11)18-12-8-16-14(17-9-12)19-7-6-15-10-19/h6-11H,1-5H2,(H,18,20)
InChIKeyNAWYHGPOBURNGW-UHFFFAOYSA-N
XLogP2.18
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-imidazol-1-ylpyrimidin-5-yl)-3,4-dihydro-2H-chromene-2-carboxamide
CID 122300947
N-(3-imidazol-1-ylphenyl)cyclopropanecarboxamide
CID 47215374
N-(2-imidazol-1-ylphenyl)cyclobutanecarboxamide
CID 12911535
2-amino-N-(6-imidazol-1-yl-3-pyridinyl)cyclohexane-1-carboxamide
CID 64822564
N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide
CID 63005414
N-[6-(cyclopentylamino)-3-pyridinyl]cyclohexanecarboxamide
CID 113009854
N-[4-(cyclopropanecarbonylamino)phenyl]cyclohexanecarboxamide
CID 25276011
N-(2-imidazol-1-ylpyrimidin-5-yl)-4-nitrobenzamide
CID 122300962
N-(2-imidazol-1-ylpyrimidin-5-yl)-4-(trifluoromethyl)benzamide
CID 121112592
N-[4-(6-imidazol-1-yl-2-methylpyrimidin-4-yl)oxyphenyl]cyclopentanecarboxamide
CID 122312977
2,4-difluoro-N-(2-imidazol-1-ylpyrimidin-5-yl)benzamide
CID 121112607
N-(2-imidazol-1-ylpyrimidin-5-yl)indolizine-2-carboxamide
CID 122300920

Frequently Asked Questions

What is the IUPAC name of N-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide?
The IUPAC name of N-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide (CID 121112570) is N-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide.
What is the SMILES notation for N-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide?
The canonical SMILES for N-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide is O=C(Nc1cnc(-n2ccnc2)nc1)C1CCCCC1.
What is the InChIKey of N-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide?
The InChIKey is NAWYHGPOBURNGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c20-13(11-4-2-1-3-5-11)18-12-8-16-14(17-9-12)19-7-6-15-10-19/h6-11H,1-5H2,(H,18,20).
What are the key properties of N-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide?
N-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazol-1-ylpyrimidin-5-yl)cyclohexanecarboxamide is sourced from PubChem (CID 121112570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).