N-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine

C17H30N4 — CID 107379872

IUPACN-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine
SMILESCC(C)CNCc1cnc(N(C)CC2CCCCC2)cn1
InChIInChI=1S/C17H30N4/c1-14(2)9-18-10-16-11-20-17(12-19-16)21(3)13-15-7-5-4-6-8-15/h11-12,14-15,18H,4-10,13H2,1-3H3
InChIKeyDRDTXUHSJFIPEG-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.24
Rot. Bonds7

About N-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine

N-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine (PubChem CID 107379872) has the molecular formula C17H30N4 and a molecular weight of 290.45 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine
PubChem CID107379872
Molecular FormulaC17H30N4
Molecular Weight290.45 g/mol
Exact Mass290.25
IUPAC NameN-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine
SMILESCC(C)CNCc1cnc(N(C)CC2CCCCC2)cn1
InChIInChI=1S/C17H30N4/c1-14(2)9-18-10-16-11-20-17(12-19-16)21(3)13-15-7-5-4-6-8-15/h11-12,14-15,18H,4-10,13H2,1-3H3
InChIKeyDRDTXUHSJFIPEG-UHFFFAOYSA-N
XLogP3.24
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine
CID 107380202
N-(cyclobutylmethyl)-N-methyl-6-[(2-methylpropylamino)methyl]pyrazin-2-amine
CID 66450489
N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine
CID 107378992
N-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]-1,3-thiazol-2-amine
CID 62752753
5-(chloromethyl)-N-(cyclobutylmethyl)-N-methylpyrazin-2-amine
CID 107373461
N-(cyclohexylmethyl)-N-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62287115
N-benzyl-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine
CID 107378891
N-(cyclopentylmethyl)-N-methyl-4-[(2-methylpropylamino)methyl]aniline
CID 63630568
N-cyclopropyl-5-[(2-methylpropylamino)methyl]-N-(2,2,2-trifluoroethyl)pyrazin-2-amine
CID 107379370
N-cyclopentyl-N-methyl-5-[(propan-2-ylamino)methyl]pyrazin-2-amine
CID 107379057
5-[(tert-butylamino)methyl]-N-methyl-N-(oxan-4-ylmethyl)pyrazin-2-amine
CID 107380315
N-(cyclopropylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]-1,3-thiazol-2-amine
CID 55112302

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine?
The IUPAC name of N-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine (CID 107379872) is N-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine.
What is the SMILES notation for N-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine?
The canonical SMILES for N-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine is CC(C)CNCc1cnc(N(C)CC2CCCCC2)cn1.
What is the InChIKey of N-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine?
The InChIKey is DRDTXUHSJFIPEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-14(2)9-18-10-16-11-20-17(12-19-16)21(3)13-15-7-5-4-6-8-15/h11-12,14-15,18H,4-10,13H2,1-3H3.
What are the key properties of N-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine?
N-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine has a molecular weight of 290.45 g/mol, XLogP of 3.24, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine is sourced from PubChem (CID 107379872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).