3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine

C12H19N3O — CID 105477990

IUPAC3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine
SMILESCOc1nc(C)nc(C2CC2)c1CCCN
InChIInChI=1S/C12H19N3O/c1-8-14-11(9-5-6-9)10(4-3-7-13)12(15-8)16-2/h9H,3-7,13H2,1-2H3
InChIKeyGDWKWPVVDIJQJQ-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.56
Rot. Bonds5

About 3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine

3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine (PubChem CID 105477990) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine.

Molecular Properties

Compound Name3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine
PubChem CID105477990
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine
SMILESCOc1nc(C)nc(C2CC2)c1CCCN
InChIInChI=1S/C12H19N3O/c1-8-14-11(9-5-6-9)10(4-3-7-13)12(15-8)16-2/h9H,3-7,13H2,1-2H3
InChIKeyGDWKWPVVDIJQJQ-UHFFFAOYSA-N
XLogP1.56
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-cyclopentyl-6-methoxypyrimidin-5-yl)propan-1-amine
CID 105496788
3-(4-tert-butyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine
CID 105499538
5-(aminomethyl)-4-cyclobutyl-6-methoxypyrimidin-2-amine
CID 105461912
(4-cyclobutyl-2,6-dimethoxypyrimidin-5-yl)methanamine
CID 105480566
(4-ethyl-6-methoxy-2-methylpyrimidin-5-yl)methanamine
CID 82408365
4-cyclobutyl-6-methoxy-2-methylpyrimidine-5-carboxylic acid
CID 82392231
4-cyclopropyl-2,5,6-trimethylpyrimidine
CID 163258333
(2,6-dimethoxy-4-methyl-3-pyridinyl)methanamine
CID 84658523
3-(6-cyclobutyl-2-methylpyrimidin-4-yl)propan-1-amine
CID 83848275
4,6-dimethoxy-2-methylpyrimidin-5-amine
CID 21239200
4-cyclopropyl-6-fluoro-5-iodo-2-methylpyrimidine
CID 164652186
3-(3-cyclopropyl-1-ethylpyrazol-4-yl)propan-1-amine
CID 112712761

Frequently Asked Questions

What is the IUPAC name of 3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine?
The IUPAC name of 3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine (CID 105477990) is 3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine.
What is the SMILES notation for 3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine?
The canonical SMILES for 3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine is COc1nc(C)nc(C2CC2)c1CCCN.
What is the InChIKey of 3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine?
The InChIKey is GDWKWPVVDIJQJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-8-14-11(9-5-6-9)10(4-3-7-13)12(15-8)16-2/h9H,3-7,13H2,1-2H3.
What are the key properties of 3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine?
3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine has a molecular weight of 221.30 g/mol, XLogP of 1.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-cyclopropyl-6-methoxy-2-methylpyrimidin-5-yl)propan-1-amine is sourced from PubChem (CID 105477990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).