4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide

C21H24N4O2 — CID 71896742

IUPAC4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide
SMILESCC1CC1C(=O)Nc1ccc(C(=O)Nc2ccc(N3CCCC3)cn2)cc1
InChIInChI=1S/C21H24N4O2/c1-14-12-18(14)21(27)23-16-6-4-15(5-7-16)20(26)24-19-9-8-17(13-22-19)25-10-2-3-11-25/h4-9,13-14,18H,2-3,10-12H2,1H3,(H,23,27)(H,22,24,26)
InChIKeyFVQMSGOQVRXLAM-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.53
Rot. Bonds5

About 4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide

4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide (PubChem CID 71896742) has the molecular formula C21H24N4O2 and a molecular weight of 364.45 g/mol. Its IUPAC name is 4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide
PubChem CID71896742
Molecular FormulaC21H24N4O2
Molecular Weight364.45 g/mol
Exact Mass364.19
IUPAC Name4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide
SMILESCC1CC1C(=O)Nc1ccc(C(=O)Nc2ccc(N3CCCC3)cn2)cc1
InChIInChI=1S/C21H24N4O2/c1-14-12-18(14)21(27)23-16-6-4-15(5-7-16)20(26)24-19-9-8-17(13-22-19)25-10-2-3-11-25/h4-9,13-14,18H,2-3,10-12H2,1H3,(H,23,27)(H,22,24,26)
InChIKeyFVQMSGOQVRXLAM-UHFFFAOYSA-N
XLogP3.53
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide
CID 32947923
N-[5-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-pyridinyl]-2-methylcyclopropane-1-carboxamide
CID 84583874
N-[5-(azepan-1-yl)-2-pyridinyl]-4-methoxybenzamide
CID 39072257
6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide
CID 154735988
N-[4-[3-(dimethylamino)pyrrolidin-1-yl]phenyl]-4-[(2-methylcyclopropanecarbonyl)amino]benzamide
CID 58866547
N-[5-(azepan-1-yl)-2-pyridinyl]cyclobutanecarboxamide
CID 113031088
2-[(6-benzamido-3-pyridinyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 167935918
N-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide
CID 32949158
4-[(2-methylcyclopropanecarbonyl)amino]-N-[4-(3-oxopiperazin-1-yl)phenyl]benzamide
CID 46473729
N-[4-[(5-morpholin-4-yl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide
CID 55540208
4-methyl-N-[6-(4-piperidin-1-ylanilino)-3-pyridinyl]benzamide
CID 113021054
3,4-dichloro-N-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]benzamide
CID 113024830

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide?
The IUPAC name of 4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide (CID 71896742) is 4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide.
What is the SMILES notation for 4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide?
The canonical SMILES for 4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide is CC1CC1C(=O)Nc1ccc(C(=O)Nc2ccc(N3CCCC3)cn2)cc1.
What is the InChIKey of 4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide?
The InChIKey is FVQMSGOQVRXLAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2/c1-14-12-18(14)21(27)23-16-6-4-15(5-7-16)20(26)24-19-9-8-17(13-22-19)25-10-2-3-11-25/h4-9,13-14,18H,2-3,10-12H2,1H3,(H,23,27)(H,22,24,26).
What are the key properties of 4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide?
4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide has a molecular weight of 364.45 g/mol, XLogP of 3.53, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylcyclopropanecarbonyl)amino]-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide is sourced from PubChem (CID 71896742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).