2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine

C15H26N4 — CID 80658060

IUPAC2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine
SMILESCCNc1cc(C)nc(CN(C)CC2CCCC2)n1
InChIInChI=1S/C15H26N4/c1-4-16-14-9-12(2)17-15(18-14)11-19(3)10-13-7-5-6-8-13/h9,13H,4-8,10-11H2,1-3H3,(H,16,17,18)
InChIKeyHJBXPKCSFNCAIR-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.84
Rot. Bonds6

About 2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine

2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine (PubChem CID 80658060) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine
PubChem CID80658060
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine
SMILESCCNc1cc(C)nc(CN(C)CC2CCCC2)n1
InChIInChI=1S/C15H26N4/c1-4-16-14-9-12(2)17-15(18-14)11-19(3)10-13-7-5-6-8-13/h9,13H,4-8,10-11H2,1-3H3,(H,16,17,18)
InChIKeyHJBXPKCSFNCAIR-UHFFFAOYSA-N
XLogP2.84
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl-methylamino]methyl]cyclobutan-1-ol
CID 80656901
2-[[cyclopentyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine
CID 80658200
2-[(dimethylamino)methyl]-N-ethyl-6-methylpyrimidin-4-amine
CID 79089446
3-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl-methylamino]propanenitrile
CID 80657126
N-ethyl-6-methyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]pyrimidin-4-amine
CID 80657417
3-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl-methylamino]-2-methylpropanenitrile
CID 80658310
N-ethyl-6-methyl-2-[(N,3,5-trimethylanilino)methyl]pyrimidin-4-amine
CID 80658105
2-[[cyclopropylmethyl(propyl)amino]methyl]-6-methyl-N-propylpyrimidin-4-amine
CID 80657938
6-methyl-2-[[methyl(propyl)amino]methyl]-N-propylpyrimidin-4-amine
CID 80657528
N-ethyl-2-[(3-ethylcyclohexyl)oxymethyl]-6-methylpyrimidin-4-amine
CID 80654787
N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-2-yl)methanamine
CID 80656005
2-[(N,2-dimethylanilino)methyl]-N-ethyl-6-methylpyrimidin-4-amine
CID 80658321

Frequently Asked Questions

What is the IUPAC name of 2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine?
The IUPAC name of 2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine (CID 80658060) is 2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine.
What is the SMILES notation for 2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine?
The canonical SMILES for 2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine is CCNc1cc(C)nc(CN(C)CC2CCCC2)n1.
What is the InChIKey of 2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine?
The InChIKey is HJBXPKCSFNCAIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-4-16-14-9-12(2)17-15(18-14)11-19(3)10-13-7-5-6-8-13/h9,13H,4-8,10-11H2,1-3H3,(H,16,17,18).
What are the key properties of 2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine?
2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine has a molecular weight of 262.40 g/mol, XLogP of 2.84, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine is sourced from PubChem (CID 80658060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).