4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine

C16H19N5 — CID 166283862

IUPAC4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine
SMILESCc1cccc2[nH]c(NCc3c4c(nn3C)CCC4)nc12
InChIInChI=1S/C16H19N5/c1-10-5-3-8-13-15(10)19-16(18-13)17-9-14-11-6-4-7-12(11)20-21(14)2/h3,5,8H,4,6-7,9H2,1-2H3,(H2,17,18,19)
InChIKeyFNAIYRSKNZGTQO-UHFFFAOYSA-N
MW281.36 g/mol
LogP2.71
Rot. Bonds3

About 4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine

4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine (PubChem CID 166283862) has the molecular formula C16H19N5 and a molecular weight of 281.36 g/mol. Its IUPAC name is 4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine.

Molecular Properties

Compound Name4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine
PubChem CID166283862
Molecular FormulaC16H19N5
Molecular Weight281.36 g/mol
Exact Mass281.16
IUPAC Name4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine
SMILESCc1cccc2[nH]c(NCc3c4c(nn3C)CCC4)nc12
InChIInChI=1S/C16H19N5/c1-10-5-3-8-13-15(10)19-16(18-13)17-9-14-11-6-4-7-12(11)20-21(14)2/h3,5,8H,4,6-7,9H2,1-2H3,(H2,17,18,19)
InChIKeyFNAIYRSKNZGTQO-UHFFFAOYSA-N
XLogP2.71
TPSA58.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine with MolForge

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Related Compounds

N-methyl-1-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanamine
CID 83862498
2-methyl-N-[(4-methyl-1H-benzimidazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-amine
CID 133462208
N-(2,6-dimethylphenyl)-4-methyl-1H-benzimidazol-2-amine
CID 143959541
2-[(2-methylphenyl)methylamino]-1H-benzimidazole-4-carbonitrile
CID 172634504
2,4-dichloro-5-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]benzenesulfonamide
CID 91819423
1-methyl-N-[(2-methyl-4,5,6,7-tetrahydroindazol-3-yl)methyl]-5,6-dihydro-4H-pyrimidin-2-amine
CID 122096225
N-[(4-methyl-1H-benzimidazol-2-yl)methyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine
CID 133414949
1-methyl-N-[(4-methyl-1H-benzimidazol-2-yl)methyl]-4,5-dihydroimidazol-2-amine
CID 120971911
2-(chloromethyl)-4-methyl-1H-benzimidazole
CID 12953834
N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-4-pyrrolidin-1-ylsulfonylbenzamide
CID 91819364
4-chloro-N-[[2-(1-methylpyrazol-3-yl)-1,3-thiazol-4-yl]methyl]-1H-benzimidazol-2-amine
CID 167920087
4-methyl-1H-benzimidazol-2-amine;trihydrate;trihydrochloride
CID 141030572

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine?
The IUPAC name of 4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine (CID 166283862) is 4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine.
What is the SMILES notation for 4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine?
The canonical SMILES for 4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine is Cc1cccc2[nH]c(NCc3c4c(nn3C)CCC4)nc12.
What is the InChIKey of 4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine?
The InChIKey is FNAIYRSKNZGTQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5/c1-10-5-3-8-13-15(10)19-16(18-13)17-9-14-11-6-4-7-12(11)20-21(14)2/h3,5,8H,4,6-7,9H2,1-2H3,(H2,17,18,19).
What are the key properties of 4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine?
4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine has a molecular weight of 281.36 g/mol, XLogP of 2.71, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]-1H-benzimidazol-2-amine is sourced from PubChem (CID 166283862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).