N-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine

C14H23N3O — CID 114125759

IUPACN-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine
SMILESCCC1(CNc2nc(C)cc(OC)n2)CCCC1
InChIInChI=1S/C14H23N3O/c1-4-14(7-5-6-8-14)10-15-13-16-11(2)9-12(17-13)18-3/h9H,4-8,10H2,1-3H3,(H,15,16,17)
InChIKeyDGTDDJCZDQNDIX-UHFFFAOYSA-N
MW249.36 g/mol
LogP3.18
Rot. Bonds5

About N-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine

N-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine (PubChem CID 114125759) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine.

Molecular Properties

Compound NameN-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine
PubChem CID114125759
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine
SMILESCCC1(CNc2nc(C)cc(OC)n2)CCCC1
InChIInChI=1S/C14H23N3O/c1-4-14(7-5-6-8-14)10-15-13-16-11(2)9-12(17-13)18-3/h9H,4-8,10H2,1-3H3,(H,15,16,17)
InChIKeyDGTDDJCZDQNDIX-UHFFFAOYSA-N
XLogP3.18
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-ethylcyclopentyl)methyl]-4-methoxypyrimidin-2-amine
CID 114125798
N-[(1-ethylcyclobutyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine
CID 114108518
4,6-dimethoxy-N-[(1-methylcyclopentyl)methyl]pyrimidin-2-amine
CID 115355130
N-[[1-(aminomethyl)cyclohexyl]methyl]-4-methyl-6-propan-2-yloxypyrimidin-2-amine
CID 103970503
N-[[1-(chloromethyl)cyclohexyl]methyl]-4-methyl-6-propan-2-yloxypyrimidin-2-amine
CID 103969249
1-[[(4,6-dimethoxypyrimidin-2-yl)amino]methyl]cyclopentan-1-ol
CID 115355172
4,6-dimethoxy-N-[(1-methoxycyclobutyl)methyl]pyrimidin-2-amine
CID 114119677
1-[[(4-methyl-6-propan-2-yloxypyrimidin-2-yl)amino]methyl]cyclopentan-1-ol
CID 112637995
N-(1-ethylcyclobutyl)-4,6-dimethoxypyrimidin-2-amine
CID 113488860
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-4-methoxy-6-methylpyrimidin-2-amine
CID 154735469
N-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine
CID 103764979
4-methoxy-6-methyl-N-[(4-methylcyclohexyl)methyl]pyrimidin-2-amine
CID 112637620

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine?
The IUPAC name of N-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine (CID 114125759) is N-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine.
What is the SMILES notation for N-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine?
The canonical SMILES for N-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine is CCC1(CNc2nc(C)cc(OC)n2)CCCC1.
What is the InChIKey of N-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine?
The InChIKey is DGTDDJCZDQNDIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-4-14(7-5-6-8-14)10-15-13-16-11(2)9-12(17-13)18-3/h9H,4-8,10H2,1-3H3,(H,15,16,17).
What are the key properties of N-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine?
N-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine has a molecular weight of 249.36 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine is sourced from PubChem (CID 114125759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).