3-methoxy-N-(2-phenylpropyl)pyridin-2-amine

C15H18N2O — CID 113430232

IUPAC3-methoxy-N-(2-phenylpropyl)pyridin-2-amine
SMILESCOc1cccnc1NCC(C)c1ccccc1
InChIInChI=1S/C15H18N2O/c1-12(13-7-4-3-5-8-13)11-17-15-14(18-2)9-6-10-16-15/h3-10,12H,11H2,1-2H3,(H,16,17)
InChIKeyMXXHNSIWDVXELW-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.31
Rot. Bonds5

About 3-methoxy-N-(2-phenylpropyl)pyridin-2-amine

3-methoxy-N-(2-phenylpropyl)pyridin-2-amine (PubChem CID 113430232) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 3-methoxy-N-(2-phenylpropyl)pyridin-2-amine.

Molecular Properties

Compound Name3-methoxy-N-(2-phenylpropyl)pyridin-2-amine
PubChem CID113430232
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name3-methoxy-N-(2-phenylpropyl)pyridin-2-amine
SMILESCOc1cccnc1NCC(C)c1ccccc1
InChIInChI=1S/C15H18N2O/c1-12(13-7-4-3-5-8-13)11-17-15-14(18-2)9-6-10-16-15/h3-10,12H,11H2,1-2H3,(H,16,17)
InChIKeyMXXHNSIWDVXELW-UHFFFAOYSA-N
XLogP3.31
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methoxy-N-(1-phenylpropyl)pyridin-2-amine
CID 112568517
N-(3-methoxy-2-pyridinyl)-1-phenylethane-1,2-diamine
CID 113371369
4-[2-(2-phenylpropylamino)-3-pyridinyl]-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine
CID 23535911
2-N-cyclopropyl-1-N-(3-methoxy-2-pyridinyl)-2-N-methylpropane-1,2-diamine
CID 114134123
2-[(3-methoxy-2-pyridinyl)amino]acetic acid
CID 83828470
5-[(3-methoxy-2-pyridinyl)amino]pentan-2-ol
CID 106128585
2-[(3-methoxy-2-pyridinyl)amino]-1-thiophen-3-ylethanol
CID 106435613
N'-(3-methoxy-2-pyridinyl)ethane-1,2-diamine
CID 83826958
3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine
CID 114127933
N-[(1S)-1-(2-methoxyphenyl)ethyl]-2-phenylpropan-1-amine
CID 81397712
3-methoxy-N-(1-methoxy-3-methylbutan-2-yl)pyridin-2-amine
CID 115923095
N'-(3-methoxy-2-pyridinyl)-2-methylpentane-1,5-diamine
CID 106155329

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(2-phenylpropyl)pyridin-2-amine?
The IUPAC name of 3-methoxy-N-(2-phenylpropyl)pyridin-2-amine (CID 113430232) is 3-methoxy-N-(2-phenylpropyl)pyridin-2-amine.
What is the SMILES notation for 3-methoxy-N-(2-phenylpropyl)pyridin-2-amine?
The canonical SMILES for 3-methoxy-N-(2-phenylpropyl)pyridin-2-amine is COc1cccnc1NCC(C)c1ccccc1.
What is the InChIKey of 3-methoxy-N-(2-phenylpropyl)pyridin-2-amine?
The InChIKey is MXXHNSIWDVXELW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-12(13-7-4-3-5-8-13)11-17-15-14(18-2)9-6-10-16-15/h3-10,12H,11H2,1-2H3,(H,16,17).
What are the key properties of 3-methoxy-N-(2-phenylpropyl)pyridin-2-amine?
3-methoxy-N-(2-phenylpropyl)pyridin-2-amine has a molecular weight of 242.32 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(2-phenylpropyl)pyridin-2-amine is sourced from PubChem (CID 113430232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).