2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine

C14H22N4 — CID 80967096

IUPAC2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine
SMILESCCC1CCCN1c1cc(NC)nc(C2CC2)n1
InChIInChI=1S/C14H22N4/c1-3-11-5-4-8-18(11)13-9-12(15-2)16-14(17-13)10-6-7-10/h9-11H,3-8H2,1-2H3,(H,15,16,17)
InChIKeyKTICYCKXDMOBNT-UHFFFAOYSA-N
MW246.36 g/mol
LogP2.77
Rot. Bonds4

About 2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine

2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine (PubChem CID 80967096) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is 2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine
PubChem CID80967096
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC Name2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine
SMILESCCC1CCCN1c1cc(NC)nc(C2CC2)n1
InChIInChI=1S/C14H22N4/c1-3-11-5-4-8-18(11)13-9-12(15-2)16-14(17-13)10-6-7-10/h9-11H,3-8H2,1-2H3,(H,15,16,17)
InChIKeyKTICYCKXDMOBNT-UHFFFAOYSA-N
XLogP2.77
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80968033
6-(2-ethylpyrrolidin-1-yl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106770980
6-(2-ethylpyrrolidin-1-yl)-N-methyl-2-phenylpyrimidin-4-amine
CID 115915410
2-cyclopropyl-6-(4-ethylazepan-1-yl)-N-methylpyrimidin-4-amine
CID 80959321
2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine
CID 80959929
6-[(2S)-2-ethylpiperidin-1-yl]-N-methylpyrimidin-4-amine
CID 129372140
6-(2-ethylazepan-1-yl)-N-methylpyrimidin-4-amine
CID 104693081
[2-cyclopropyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine
CID 83056734
[(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol
CID 122491334
2-cyclopropyl-N-methyl-6-morpholin-4-ylpyrimidin-4-amine
CID 80956626
2-cyclopropyl-N-ethyl-6-(2-methylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80967631
4-(2-ethylazepan-1-yl)-N,6-dimethylpyrimidin-2-amine
CID 113442061

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine (CID 80967096) is 2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine is CCC1CCCN1c1cc(NC)nc(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine?
The InChIKey is KTICYCKXDMOBNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c1-3-11-5-4-8-18(11)13-9-12(15-2)16-14(17-13)10-6-7-10/h9-11H,3-8H2,1-2H3,(H,15,16,17).
What are the key properties of 2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine?
2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine has a molecular weight of 246.36 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine is sourced from PubChem (CID 80967096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).