N-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide

C24H26N6O2 — CID 53157057

IUPACN-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide
SMILESCc1ccccc1N1CCN(C(=O)c2cn(-c3ccc(NC(=O)C4CC4)cn3)cn2)CC1
InChIInChI=1S/C24H26N6O2/c1-17-4-2-3-5-21(17)28-10-12-29(13-11-28)24(32)20-15-30(16-26-20)22-9-8-19(14-25-22)27-23(31)18-6-7-18/h2-5,8-9,14-16,18H,6-7,10-13H2,1H3,(H,27,31)
InChIKeyKDVPAQRCUUWDCU-UHFFFAOYSA-N
MW430.51 g/mol
LogP2.89
Rot. Bonds5

About N-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide

N-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide (PubChem CID 53157057) has the molecular formula C24H26N6O2 and a molecular weight of 430.51 g/mol. Its IUPAC name is N-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide
PubChem CID53157057
Molecular FormulaC24H26N6O2
Molecular Weight430.51 g/mol
Exact Mass430.21
IUPAC NameN-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide
SMILESCc1ccccc1N1CCN(C(=O)c2cn(-c3ccc(NC(=O)C4CC4)cn3)cn2)CC1
InChIInChI=1S/C24H26N6O2/c1-17-4-2-3-5-21(17)28-10-12-29(13-11-28)24(32)20-15-30(16-26-20)22-9-8-19(14-25-22)27-23(31)18-6-7-18/h2-5,8-9,14-16,18H,6-7,10-13H2,1H3,(H,27,31)
InChIKeyKDVPAQRCUUWDCU-UHFFFAOYSA-N
XLogP2.89
TPSA83.36 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.51
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[6-[4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide
CID 53157056
N-[6-[4-[4-(2-fluorophenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]-2-methylpropanamide
CID 53156980
N-[6-[4-[4-(3-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]propanamide
CID 53156945
N-cycloheptyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]imidazole-4-carboxamide
CID 53157027
N-[6-[4-(3,5-dimethylpiperidine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]propanamide
CID 53156927
N-[6-[4-(4-benzylpiperazine-1-carbonyl)imidazol-1-yl]-3-pyridinyl]-2-methylpropanamide
CID 53156979
3-methyl-N-[6-[4-(morpholine-4-carbonyl)imidazol-1-yl]-3-pyridinyl]butanamide
CID 53156987
[4-(2-methylphenyl)piperazin-1-yl]-(6-methyl-3-pyridinyl)methanone
CID 18147919
N-[6-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethoxy]-3-pyridinyl]cyclopropanecarboxamide
CID 53175013
N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]cyclopropanecarboxamide
CID 113011542
N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]cyclopropanecarboxamide
CID 113015446
N-[6-[4-(2-phenoxyacetyl)piperazin-1-yl]-3-pyridinyl]cyclopentanecarboxamide
CID 42850034

Frequently Asked Questions

What is the IUPAC name of N-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide?
The IUPAC name of N-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide (CID 53157057) is N-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide?
The canonical SMILES for N-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide is Cc1ccccc1N1CCN(C(=O)c2cn(-c3ccc(NC(=O)C4CC4)cn3)cn2)CC1.
What is the InChIKey of N-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide?
The InChIKey is KDVPAQRCUUWDCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N6O2/c1-17-4-2-3-5-21(17)28-10-12-29(13-11-28)24(32)20-15-30(16-26-20)22-9-8-19(14-25-22)27-23(31)18-6-7-18/h2-5,8-9,14-16,18H,6-7,10-13H2,1H3,(H,27,31).
What are the key properties of N-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide?
N-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide has a molecular weight of 430.51 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]imidazol-1-yl]-3-pyridinyl]cyclopropanecarboxamide is sourced from PubChem (CID 53157057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).