N-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine

C19H26N2 — CID 116544152

IUPACN-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine
SMILESCCCNC(c1cccc(CCC)c1)c1ncccc1C
InChIInChI=1S/C19H26N2/c1-4-8-16-10-6-11-17(14-16)19(20-12-5-2)18-15(3)9-7-13-21-18/h6-7,9-11,13-14,19-20H,4-5,8,12H2,1-3H3
InChIKeyOLMLDIIHZCDMIA-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.43
Rot. Bonds7

About N-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine

N-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine (PubChem CID 116544152) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine
PubChem CID116544152
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC NameN-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine
SMILESCCCNC(c1cccc(CCC)c1)c1ncccc1C
InChIInChI=1S/C19H26N2/c1-4-8-16-10-6-11-17(14-16)19(20-12-5-2)18-15(3)9-7-13-21-18/h6-7,9-11,13-14,19-20H,4-5,8,12H2,1-3H3
InChIKeyOLMLDIIHZCDMIA-UHFFFAOYSA-N
XLogP4.43
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(3-methyl-2-pyridinyl)-1-(3-propylphenyl)methanamine
CID 116544148
N-[(3-methyl-4-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine
CID 116545019
N-[(4-methylphenyl)-(3-propylphenyl)methyl]propan-1-amine
CID 116543927
N-[1-(3-propylphenyl)ethyl]propan-1-amine
CID 116544021
[(3-chloro-2-pyridinyl)-(3-propylphenyl)methyl]hydrazine
CID 103445653
N-[(1,5-dimethylpyrazol-4-yl)-(3-propylphenyl)methyl]propan-1-amine
CID 105187854
N-[(3-ethyl-2-pyridinyl)-(3-fluorophenyl)methyl]propan-1-amine
CID 82741174
N-[(4-methoxy-2-methylphenyl)-(3-methyl-2-pyridinyl)methyl]propan-1-amine
CID 65313561
N-[(3-chloro-4-methylphenyl)-(3-propylphenyl)methyl]ethanamine
CID 105050507
N-[(5-ethylthiophen-2-yl)-(3-propylphenyl)methyl]propan-1-amine
CID 105050309
N-[(5-bromothiophen-2-yl)-(3-propylphenyl)methyl]propan-1-amine
CID 116544380
N-[(3-chloro-2-pyridinyl)-(4-fluoro-3-methylphenyl)methyl]propan-1-amine
CID 103444823

Frequently Asked Questions

What is the IUPAC name of N-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine?
The IUPAC name of N-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine (CID 116544152) is N-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine.
What is the SMILES notation for N-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine?
The canonical SMILES for N-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine is CCCNC(c1cccc(CCC)c1)c1ncccc1C.
What is the InChIKey of N-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine?
The InChIKey is OLMLDIIHZCDMIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-4-8-16-10-6-11-17(14-16)19(20-12-5-2)18-15(3)9-7-13-21-18/h6-7,9-11,13-14,19-20H,4-5,8,12H2,1-3H3.
What are the key properties of N-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine?
N-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine has a molecular weight of 282.43 g/mol, XLogP of 4.43, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methyl-2-pyridinyl)-(3-propylphenyl)methyl]propan-1-amine is sourced from PubChem (CID 116544152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).