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

C13H21N3 — CID 103764979

IUPACN-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine
SMILESCCC1(CNc2cc(C)ncn2)CCCC1
InChIInChI=1S/C13H21N3/c1-3-13(6-4-5-7-13)9-14-12-8-11(2)15-10-16-12/h8,10H,3-7,9H2,1-2H3,(H,14,15,16)
InChIKeyRDDLNVRGKFYRFP-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.17
Rot. Bonds4

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

N-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine (PubChem CID 103764979) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is N-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine
PubChem CID103764979
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC NameN-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine
SMILESCCC1(CNc2cc(C)ncn2)CCCC1
InChIInChI=1S/C13H21N3/c1-3-13(6-4-5-7-13)9-14-12-8-11(2)15-10-16-12/h8,10H,3-7,9H2,1-2H3,(H,14,15,16)
InChIKeyRDDLNVRGKFYRFP-UHFFFAOYSA-N
XLogP3.17
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-N-[(1-propylcyclopropyl)methyl]pyrimidin-4-amine
CID 103761666
6-methyl-N-[(1-methylcyclopentyl)methyl]pyrimidin-4-amine
CID 63830485
[1-[[(6-ethylpyrimidin-4-yl)amino]methyl]cyclohexyl]methanol
CID 112697562
[1-[[[6-(ethylamino)pyrimidin-4-yl]amino]methyl]cyclohexyl]methanol
CID 103968726
N-[[1-(chloromethyl)cyclopentyl]methyl]-6-ethoxypyrimidin-4-amine
CID 113294686
[1-[[(6-ethoxypyrimidin-4-yl)amino]methyl]cyclohexyl]methanol
CID 103967277
[1-[[(6-propoxypyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 115360640
N-[[1-(chloromethyl)cyclopentyl]methyl]-6-methoxypyrimidin-4-amine
CID 115363649
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-6-methylpyrimidin-4-amine
CID 133297192
[1-[[(6-chloropyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 115361870
4-[(1-ethylcyclobutyl)methylamino]-1H-pyrimidin-6-one
CID 136857200
[1-[[(6-aminopyrimidin-4-yl)amino]methyl]cyclohexyl]methanol
CID 113359835

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine?
The IUPAC name of N-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine (CID 103764979) is N-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine.
What is the SMILES notation for N-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine?
The canonical SMILES for N-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine is CCC1(CNc2cc(C)ncn2)CCCC1.
What is the InChIKey of N-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine?
The InChIKey is RDDLNVRGKFYRFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-3-13(6-4-5-7-13)9-14-12-8-11(2)15-10-16-12/h8,10H,3-7,9H2,1-2H3,(H,14,15,16).
What are the key properties of N-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine?
N-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine has a molecular weight of 219.33 g/mol, XLogP of 3.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine is sourced from PubChem (CID 103764979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).