N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine

C18H16N6 — CID 133466685

IUPACN-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine
SMILESc1ccc2c(c1)nc(CNc1ccc3nccnc3n1)n2C1CC1
InChIInChI=1S/C18H16N6/c1-2-4-15-13(3-1)22-17(24(15)12-5-6-12)11-21-16-8-7-14-18(23-16)20-10-9-19-14/h1-4,7-10,12H,5-6,11H2,(H,20,21,23)
InChIKeyMYSQOEHASZVIFI-UHFFFAOYSA-N
MW316.37 g/mol
LogP3.32
Rot. Bonds4

About N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine

N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine (PubChem CID 133466685) has the molecular formula C18H16N6 and a molecular weight of 316.37 g/mol. Its IUPAC name is N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine.

Molecular Properties

Compound NameN-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine
PubChem CID133466685
Molecular FormulaC18H16N6
Molecular Weight316.37 g/mol
Exact Mass316.14
IUPAC NameN-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine
SMILESc1ccc2c(c1)nc(CNc1ccc3nccnc3n1)n2C1CC1
InChIInChI=1S/C18H16N6/c1-2-4-15-13(3-1)22-17(24(15)12-5-6-12)11-21-16-8-7-14-18(23-16)20-10-9-19-14/h1-4,7-10,12H,5-6,11H2,(H,20,21,23)
InChIKeyMYSQOEHASZVIFI-UHFFFAOYSA-N
XLogP3.32
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.37
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine
CID 43142730
3-[(1-cyclopropylbenzimidazol-2-yl)methylamino]-1-ethylpyrazin-2-one
CID 133466705
N-[(1-cyclopropylbenzimidazol-2-yl)methyl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 133466669
6-chloro-2-[(1-cyclopropylbenzimidazol-2-yl)methylamino]quinoline-4-carbonitrile
CID 133466696
2-(chloromethyl)-1-cyclobutylbenzimidazole
CID 62416767
N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyridine-3-carboxamide
CID 110712108
N-[(2-ethylphenyl)methyl]pyrido[2,3-b]pyrazin-6-amine
CID 79003296
N-[(2-chlorophenyl)methyl]pyrido[2,3-b]pyrazin-6-amine
CID 78981083
5-chloro-6-[(1-cyclopropylbenzimidazol-2-yl)methylamino]pyridine-3-carbonitrile
CID 133466787
2-chloro-N-[(1-cyclopropylbenzimidazol-2-yl)methyl]acetamide;hydrochloride
CID 146089283
N'-pyrido[2,3-b]pyrazin-6-yl-N-quinolin-2-ylethane-1,2-diamine
CID 133309761
N-[(1-cyclopropylbenzimidazol-2-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 136530963

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine?
The IUPAC name of N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine (CID 133466685) is N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine.
What is the SMILES notation for N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine?
The canonical SMILES for N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine is c1ccc2c(c1)nc(CNc1ccc3nccnc3n1)n2C1CC1.
What is the InChIKey of N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine?
The InChIKey is MYSQOEHASZVIFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N6/c1-2-4-15-13(3-1)22-17(24(15)12-5-6-12)11-21-16-8-7-14-18(23-16)20-10-9-19-14/h1-4,7-10,12H,5-6,11H2,(H,20,21,23).
What are the key properties of N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine?
N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine has a molecular weight of 316.37 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine is sourced from PubChem (CID 133466685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).