(2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine

C15H19N3 — CID 116544988

IUPAC(2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine
SMILESCCCc1cccc(C(N)c2ccnc(C)n2)c1
InChIInChI=1S/C15H19N3/c1-3-5-12-6-4-7-13(10-12)15(16)14-8-9-17-11(2)18-14/h4,6-10,15H,3,5,16H2,1-2H3
InChIKeySANZHNXRDRKODO-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.79
Rot. Bonds4

About (2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine

(2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine (PubChem CID 116544988) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is (2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine.

Molecular Properties

Compound Name(2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine
PubChem CID116544988
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name(2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine
SMILESCCCc1cccc(C(N)c2ccnc(C)n2)c1
InChIInChI=1S/C15H19N3/c1-3-5-12-6-4-7-13(10-12)15(16)14-8-9-17-11(2)18-14/h4,6-10,15H,3,5,16H2,1-2H3
InChIKeySANZHNXRDRKODO-UHFFFAOYSA-N
XLogP2.79
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3,5-dimethylphenyl)-(2-methylpyrimidin-4-yl)methanamine
CID 115530103
(2-methylpyrimidin-4-yl)-pyridin-3-ylmethanamine
CID 115530395
1-(3-propylphenyl)ethanamine
CID 116543909
(3-propoxyphenyl)-(3-propylphenyl)methanamine
CID 105050359
(3-ethoxyphenyl)-(3-propylphenyl)methanamine
CID 116543834
(3,5-dimethoxyphenyl)-(2-methylpyrimidin-4-yl)methanamine
CID 115530269
(2-methylpyrimidin-4-yl)-quinolin-3-ylmethanamine
CID 115530428
(3-propylphenyl)-(1,3,5-trimethylpyrazol-4-yl)methanamine
CID 105187932
(3,5-dibromo-2-pyridinyl)-(3-propylphenyl)methanamine
CID 116545102
(3-propylphenyl)-thiophen-3-ylmethanamine
CID 116543884
(5-bromo-3-pyridinyl)-(3-propylphenyl)methanamine
CID 116544831
(2-fluoro-5-methylphenyl)-(3-propylphenyl)methanamine
CID 105050249

Frequently Asked Questions

What is the IUPAC name of (2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine?
The IUPAC name of (2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine (CID 116544988) is (2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine.
What is the SMILES notation for (2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine?
The canonical SMILES for (2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine is CCCc1cccc(C(N)c2ccnc(C)n2)c1.
What is the InChIKey of (2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine?
The InChIKey is SANZHNXRDRKODO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-3-5-12-6-4-7-13(10-12)15(16)14-8-9-17-11(2)18-14/h4,6-10,15H,3,5,16H2,1-2H3.
What are the key properties of (2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine?
(2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine has a molecular weight of 241.34 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrimidin-4-yl)-(3-propylphenyl)methanamine is sourced from PubChem (CID 116544988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).