N-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine

C20H23N5O — CID 58303431

IUPACN-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine
SMILESc1cc2ncn(-c3cncc(NC4CCCC4)n3)c2cc1OCC1CC1
InChIInChI=1S/C20H23N5O/c1-2-4-15(3-1)23-19-10-21-11-20(24-19)25-13-22-17-8-7-16(9-18(17)25)26-12-14-5-6-14/h7-11,13-15H,1-6,12H2,(H,23,24)
InChIKeyZITSTVNEVHQADZ-UHFFFAOYSA-N
MW349.44 g/mol
LogP3.96
Rot. Bonds6

About N-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine

N-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine (PubChem CID 58303431) has the molecular formula C20H23N5O and a molecular weight of 349.44 g/mol. Its IUPAC name is N-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine
PubChem CID58303431
Molecular FormulaC20H23N5O
Molecular Weight349.44 g/mol
Exact Mass349.19
IUPAC NameN-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine
SMILESc1cc2ncn(-c3cncc(NC4CCCC4)n3)c2cc1OCC1CC1
InChIInChI=1S/C20H23N5O/c1-2-4-15(3-1)23-19-10-21-11-20(24-19)25-13-22-17-8-7-16(9-18(17)25)26-12-14-5-6-14/h7-11,13-15H,1-6,12H2,(H,23,24)
InChIKeyZITSTVNEVHQADZ-UHFFFAOYSA-N
XLogP3.96
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine?
The IUPAC name of N-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine (CID 58303431) is N-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine.
What is the SMILES notation for N-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine?
The canonical SMILES for N-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine is c1cc2ncn(-c3cncc(NC4CCCC4)n3)c2cc1OCC1CC1.
What is the InChIKey of N-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine?
The InChIKey is ZITSTVNEVHQADZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O/c1-2-4-15(3-1)23-19-10-21-11-20(24-19)25-13-22-17-8-7-16(9-18(17)25)26-12-14-5-6-14/h7-11,13-15H,1-6,12H2,(H,23,24).
What are the key properties of N-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine?
N-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine has a molecular weight of 349.44 g/mol, XLogP of 3.96, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-[6-(cyclopropylmethoxy)benzimidazol-1-yl]pyrazin-2-amine is sourced from PubChem (CID 58303431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).