N-(cyclohexylmethyl)-6-methoxypyrazin-2-amine

C12H19N3O — CID 155403653

IUPACN-(cyclohexylmethyl)-6-methoxypyrazin-2-amine
SMILESCOc1cncc(NCC2CCCCC2)n1
InChIInChI=1S/C12H19N3O/c1-16-12-9-13-8-11(15-12)14-7-10-5-3-2-4-6-10/h8-10H,2-7H2,1H3,(H,14,15)
InChIKeyVVRBNNOVWUOGQX-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.48
Rot. Bonds4

About N-(cyclohexylmethyl)-6-methoxypyrazin-2-amine

N-(cyclohexylmethyl)-6-methoxypyrazin-2-amine (PubChem CID 155403653) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-6-methoxypyrazin-2-amine.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-6-methoxypyrazin-2-amine
PubChem CID155403653
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-(cyclohexylmethyl)-6-methoxypyrazin-2-amine
SMILESCOc1cncc(NCC2CCCCC2)n1
InChIInChI=1S/C12H19N3O/c1-16-12-9-13-8-11(15-12)14-7-10-5-3-2-4-6-10/h8-10H,2-7H2,1H3,(H,14,15)
InChIKeyVVRBNNOVWUOGQX-UHFFFAOYSA-N
XLogP2.48
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-chlorocyclohexyl)methyl]-6-methoxypyrazin-2-amine
CID 106125259
N-[(3-aminocyclopentyl)methyl]-6-methoxypyrazin-2-amine
CID 106126810
N-ethyl-6-methoxypyrazin-2-amine
CID 21419063
N-cyclopropyl-6-methoxypyrazin-2-amine
CID 127009614
6-methoxy-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine
CID 104973532
N-(cyclopentylmethyl)-4,6-dimethoxypyrimidin-2-amine
CID 113278339
N-(cyclohexylmethyl)-5-methylpyridazin-3-amine
CID 106549505
N-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine
CID 80932571
N-[(2-chlorocyclohexyl)methyl]-6-ethoxypyrazin-2-amine
CID 65028885
N-[[1-(aminomethyl)cyclopentyl]methyl]-6-methoxypyrazin-2-amine
CID 113295240
N-[2-(2-chloroethoxy)ethyl]-6-methoxypyrazin-2-amine
CID 65027262
N-[(2-chlorocyclohexyl)methyl]-6-propan-2-yloxypyrazin-2-amine
CID 65028110

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-6-methoxypyrazin-2-amine?
The IUPAC name of N-(cyclohexylmethyl)-6-methoxypyrazin-2-amine (CID 155403653) is N-(cyclohexylmethyl)-6-methoxypyrazin-2-amine.
What is the SMILES notation for N-(cyclohexylmethyl)-6-methoxypyrazin-2-amine?
The canonical SMILES for N-(cyclohexylmethyl)-6-methoxypyrazin-2-amine is COc1cncc(NCC2CCCCC2)n1.
What is the InChIKey of N-(cyclohexylmethyl)-6-methoxypyrazin-2-amine?
The InChIKey is VVRBNNOVWUOGQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-16-12-9-13-8-11(15-12)14-7-10-5-3-2-4-6-10/h8-10H,2-7H2,1H3,(H,14,15).
What are the key properties of N-(cyclohexylmethyl)-6-methoxypyrazin-2-amine?
N-(cyclohexylmethyl)-6-methoxypyrazin-2-amine has a molecular weight of 221.30 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-6-methoxypyrazin-2-amine is sourced from PubChem (CID 155403653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).