1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine

C19H23NO — CID 105052563

IUPAC1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine
SMILESCNC(c1ccc(C)c(OC)c1)C1CC1c1ccccc1
InChIInChI=1S/C19H23NO/c1-13-9-10-15(11-18(13)21-3)19(20-2)17-12-16(17)14-7-5-4-6-8-14/h4-11,16-17,19-20H,12H2,1-3H3
InChIKeyGPFWTMSACYQDQW-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.07
Rot. Bonds5

About 1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine

1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine (PubChem CID 105052563) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine.

Molecular Properties

Compound Name1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine
PubChem CID105052563
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine
SMILESCNC(c1ccc(C)c(OC)c1)C1CC1c1ccccc1
InChIInChI=1S/C19H23NO/c1-13-9-10-15(11-18(13)21-3)19(20-2)17-12-16(17)14-7-5-4-6-8-14/h4-11,16-17,19-20H,12H2,1-3H3
InChIKeyGPFWTMSACYQDQW-UHFFFAOYSA-N
XLogP4.07
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine
CID 105052597
1-(3,5-difluorophenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine
CID 116517417
1-(4-methoxy-1-methylpyrazol-5-yl)-N-methyl-1-(2-phenylcyclopropyl)methanamine
CID 105047333
1-(3-ethylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine
CID 105018905
1-(3-chloro-5-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine
CID 105052707
1-(3-methoxy-4-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine
CID 105066144
1-(5-bromothiophen-3-yl)-N-methyl-1-(2-phenylcyclopropyl)methanamine
CID 105189078
[(4-bromo-3-methylphenyl)-(2-phenylcyclopropyl)methyl]hydrazine
CID 105341455
1-(2-bromo-5-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine
CID 105052519
[cyclopropyl-(3-methoxy-4-methylphenyl)methyl]hydrazine
CID 105314485
[(3-methylphenyl)-(2-phenylcyclopropyl)methyl]hydrazine
CID 105200887
2-methoxy-1-methyl-4-(1-phenylethyl)benzene
CID 57234669

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine?
The IUPAC name of 1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine (CID 105052563) is 1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine.
What is the SMILES notation for 1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine?
The canonical SMILES for 1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine is CNC(c1ccc(C)c(OC)c1)C1CC1c1ccccc1.
What is the InChIKey of 1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine?
The InChIKey is GPFWTMSACYQDQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-13-9-10-15(11-18(13)21-3)19(20-2)17-12-16(17)14-7-5-4-6-8-14/h4-11,16-17,19-20H,12H2,1-3H3.
What are the key properties of 1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine?
1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine has a molecular weight of 281.40 g/mol, XLogP of 4.07, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxy-4-methylphenyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine is sourced from PubChem (CID 105052563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).