N-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine

C14H24N4 — CID 103970489

IUPACN-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine
SMILESCc1cc(NCC2(CN)CCCCC2)nc(C)n1
InChIInChI=1S/C14H24N4/c1-11-8-13(18-12(2)17-11)16-10-14(9-15)6-4-3-5-7-14/h8H,3-7,9-10,15H2,1-2H3,(H,16,17,18)
InChIKeyVJTDVKLYULULIB-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.41
Rot. Bonds4

About N-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine

N-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine (PubChem CID 103970489) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine
PubChem CID103970489
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC NameN-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine
SMILESCc1cc(NCC2(CN)CCCCC2)nc(C)n1
InChIInChI=1S/C14H24N4/c1-11-8-13(18-12(2)17-11)16-10-14(9-15)6-4-3-5-7-14/h8H,3-7,9-10,15H2,1-2H3,(H,16,17,18)
InChIKeyVJTDVKLYULULIB-UHFFFAOYSA-N
XLogP2.41
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(aminomethyl)cyclopropyl]methyl]-6-ethyl-2-methylpyrimidin-4-amine
CID 115457082
N-[[1-(aminomethyl)cyclopentyl]methyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 115366095
7-[[1-(aminomethyl)cyclopentyl]methylamino]-5-methyl-2H-[1,2,4]triazolo[4,3-c]pyrimidin-3-one
CID 115366008
N-[[1-(aminomethyl)cyclohexyl]methyl]-4-methyl-6-propan-2-yloxypyrimidin-2-amine
CID 103970503
N-[[1-(aminomethyl)cyclopentyl]methyl]-2-methylquinolin-4-amine
CID 115366049
N-[[1-(chloromethyl)cyclopentyl]methyl]-6-methoxy-2-methylpyrimidin-4-amine
CID 115363600
N-[[1-(aminomethyl)cyclohexyl]methyl]aniline
CID 115438130
N-[[1-(aminomethyl)cyclohexyl]methyl]pyridin-2-amine
CID 103970402
N-[[1-(aminomethyl)cyclohexyl]methyl]-2,5-dimethylpyrazole-3-carboxamide
CID 103970196
N-[(1-ethylcyclobutyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine
CID 114108518
N-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine
CID 103970448
N-[[1-(aminomethyl)cyclopentyl]methyl]-6-methoxypyrazin-2-amine
CID 113295240

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine?
The IUPAC name of N-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine (CID 103970489) is N-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine.
What is the SMILES notation for N-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine?
The canonical SMILES for N-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine is Cc1cc(NCC2(CN)CCCCC2)nc(C)n1.
What is the InChIKey of N-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine?
The InChIKey is VJTDVKLYULULIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-11-8-13(18-12(2)17-11)16-10-14(9-15)6-4-3-5-7-14/h8H,3-7,9-10,15H2,1-2H3,(H,16,17,18).
What are the key properties of N-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine?
N-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine has a molecular weight of 248.37 g/mol, XLogP of 2.41, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclohexyl]methyl]-2,6-dimethylpyrimidin-4-amine is sourced from PubChem (CID 103970489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).