(4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine

C16H25NO — CID 82296040

IUPAC(4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine
SMILESCOc1cc(C)c(C(N)C2(C)CC2)cc1C(C)C
InChIInChI=1S/C16H25NO/c1-10(2)12-9-13(11(3)8-14(12)18-5)15(17)16(4)6-7-16/h8-10,15H,6-7,17H2,1-5H3
InChIKeyAGVSZLRLHHSPIV-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.93
Rot. Bonds4

About (4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine

(4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine (PubChem CID 82296040) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is (4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine.

Molecular Properties

Compound Name(4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine
PubChem CID82296040
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name(4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine
SMILESCOc1cc(C)c(C(N)C2(C)CC2)cc1C(C)C
InChIInChI=1S/C16H25NO/c1-10(2)12-9-13(11(3)8-14(12)18-5)15(17)16(4)6-7-16/h8-10,15H,6-7,17H2,1-5H3
InChIKeyAGVSZLRLHHSPIV-UHFFFAOYSA-N
XLogP3.93
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)-(methylamino)methyl]cyclopropan-1-amine
CID 116961202
1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethylhydrazine
CID 82473084
1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)pentane-1,4-diamine
CID 116934324
azetidin-3-yl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanamine
CID 116935315
2-cyclopropyl-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanamine
CID 69279572
2,3-diamino-3-(4-methoxy-2-methyl-5-propan-2-ylphenyl)propan-1-ol
CID 116942367
1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-2-sulfanylethanol
CID 116829986
(4-methoxy-2-methyl-5-propan-2-ylphenyl)-(methylamino)methanol
CID 116954652
(1-aminocyclopropyl)-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone
CID 116924291
3-amino-3-(4-methoxy-2-methyl-5-propan-2-ylphenyl)propanehydrazide
CID 116848764
[(4-methoxy-2,5-dimethylphenyl)-(1-methylcyclopropyl)methyl]hydrazine
CID 105253560
[1-[amino-(4,5-dimethoxy-2-methylphenyl)methyl]cyclopropyl]methanol
CID 116943251

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine?
The IUPAC name of (4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine (CID 82296040) is (4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine.
What is the SMILES notation for (4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine?
The canonical SMILES for (4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine is COc1cc(C)c(C(N)C2(C)CC2)cc1C(C)C.
What is the InChIKey of (4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine?
The InChIKey is AGVSZLRLHHSPIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-10(2)12-9-13(11(3)8-14(12)18-5)15(17)16(4)6-7-16/h8-10,15H,6-7,17H2,1-5H3.
What are the key properties of (4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine?
(4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine has a molecular weight of 247.38 g/mol, XLogP of 3.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine is sourced from PubChem (CID 82296040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).