N-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine

C15H19N3 — CID 102923924

IUPACN-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine
SMILESCCCc1cccc(C(NC)c2cncnc2)c1
InChIInChI=1S/C15H19N3/c1-3-5-12-6-4-7-13(8-12)15(16-2)14-9-17-11-18-10-14/h4,6-11,15-16H,3,5H2,1-2H3
InChIKeyBVNGFWRLWXJOAG-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.74
Rot. Bonds5

About N-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine

N-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine (PubChem CID 102923924) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine.

Molecular Properties

Compound NameN-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine
PubChem CID102923924
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine
SMILESCCCc1cccc(C(NC)c2cncnc2)c1
InChIInChI=1S/C15H19N3/c1-3-5-12-6-4-7-13(8-12)15(16-2)14-9-17-11-18-10-14/h4,6-11,15-16H,3,5H2,1-2H3
InChIKeyBVNGFWRLWXJOAG-UHFFFAOYSA-N
XLogP2.74
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(4-propan-2-ylphenyl)-1-(3-propylphenyl)methanamine
CID 116543873
N-methyl-1-(3-methylphenyl)-1-pyrimidin-5-ylmethanamine
CID 62491535
1-(3-bromophenyl)-N-methyl-1-pyrimidin-5-ylmethanamine
CID 62491207
[(3-ethylphenyl)-pyrimidin-5-ylmethyl]hydrazine
CID 102924271
1-(3-chloro-4-methylphenyl)-N-methyl-1-(3-propylphenyl)methanamine
CID 105050563
1-(4-bromo-3-methylphenyl)-N-methyl-1-(3-propylphenyl)methanamine
CID 105050441
1-(2-methoxyphenyl)-N-methyl-1-(3-propylphenyl)methanamine
CID 116543823
N-methyl-1-(3-propylphenyl)ethanamine
CID 59900502
1-(2-bromophenyl)-N-methyl-1-(3-propylphenyl)methanamine
CID 116544137
1-(3-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)methanamine
CID 105171226
N-methyl-1-(3-methyl-2-pyridinyl)-1-(3-propylphenyl)methanamine
CID 116544148
1-(3,6-dimethylpyridazin-4-yl)-N-methyl-1-(3-propylphenyl)methanamine
CID 105187892

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine?
The IUPAC name of N-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine (CID 102923924) is N-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine.
What is the SMILES notation for N-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine?
The canonical SMILES for N-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine is CCCc1cccc(C(NC)c2cncnc2)c1.
What is the InChIKey of N-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine?
The InChIKey is BVNGFWRLWXJOAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-3-5-12-6-4-7-13(8-12)15(16-2)14-9-17-11-18-10-14/h4,6-11,15-16H,3,5H2,1-2H3.
What are the key properties of N-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine?
N-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine has a molecular weight of 241.34 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-propylphenyl)-1-pyrimidin-5-ylmethanamine is sourced from PubChem (CID 102923924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).