N-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide

C17H16N6O — CID 155525697

IUPACN-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide
SMILESCc1nc(-c2cncnc2)c(-c2ccnc(NC(=O)C3CC3)c2)[nH]1
InChIInChI=1S/C17H16N6O/c1-10-21-15(16(22-10)13-7-18-9-19-8-13)12-4-5-20-14(6-12)23-17(24)11-2-3-11/h4-9,11H,2-3H2,1H3,(H,21,22)(H,20,23,24)
InChIKeyGRUJGZNTZIFASD-UHFFFAOYSA-N
MW320.36 g/mol
LogP2.59
Rot. Bonds4

About N-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide

N-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide (PubChem CID 155525697) has the molecular formula C17H16N6O and a molecular weight of 320.36 g/mol. Its IUPAC name is N-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide
PubChem CID155525697
Molecular FormulaC17H16N6O
Molecular Weight320.36 g/mol
Exact Mass320.14
IUPAC NameN-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide
SMILESCc1nc(-c2cncnc2)c(-c2ccnc(NC(=O)C3CC3)c2)[nH]1
InChIInChI=1S/C17H16N6O/c1-10-21-15(16(22-10)13-7-18-9-19-8-13)12-4-5-20-14(6-12)23-17(24)11-2-3-11/h4-9,11H,2-3H2,1H3,(H,21,22)(H,20,23,24)
InChIKeyGRUJGZNTZIFASD-UHFFFAOYSA-N
XLogP2.59
TPSA96.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.36
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(5-cyclopropyl-2-methyl-1H-imidazol-4-yl)-2-pyridinyl]cyclopropanecarboxamide
CID 155562118
N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide
CID 138989340
N-[4-[4-(aminomethyl)-3-methylphenyl]-2-pyridinyl]cyclopropanecarboxamide
CID 155288152
1-[2-chloro-4-[2-(cyclopropanecarbonylamino)-4-pyridinyl]phenyl]ethylcarbamic acid
CID 155288407
N-(4-ethyl-2-pyridinyl)cyclopropanecarboxamide
CID 89291693
N-[4-[3-(2-hydroxyacetyl)quinolin-6-yl]-2-pyridinyl]piperidine-4-carboxamide
CID 58525613
N-[4-[3-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]phenyl]-2-pyridinyl]cyclopropanecarboxamide
CID 129261123
N-[4-[2-benzylsulfanyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-2-pyridinyl]cyclopentanecarboxamide
CID 155512392
N-[3-[5-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-3-pyridinyl]-4-methylphenyl]-6-(trifluoromethyl)pyrazine-2-carboxamide
CID 176572342
2-(cyclopropanecarbonylamino)-N-[5-(2,5-dimethylthiophen-3-yl)-3-pyridinyl]pyridine-4-carboxamide
CID 118064448
N-pyrazin-2-ylpiperidine-4-carboxamide
CID 43616167
1-(2-methylpropyl)-N-[4-(1H-pyrrolo[2,3-c]pyridin-3-yl)-2-pyridinyl]piperidine-4-carboxamide
CID 168926332

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide (CID 155525697) is N-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide is Cc1nc(-c2cncnc2)c(-c2ccnc(NC(=O)C3CC3)c2)[nH]1.
What is the InChIKey of N-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide?
The InChIKey is GRUJGZNTZIFASD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N6O/c1-10-21-15(16(22-10)13-7-18-9-19-8-13)12-4-5-20-14(6-12)23-17(24)11-2-3-11/h4-9,11H,2-3H2,1H3,(H,21,22)(H,20,23,24).
What are the key properties of N-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide?
N-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide has a molecular weight of 320.36 g/mol, XLogP of 2.59, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide is sourced from PubChem (CID 155525697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).