(4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine

C13H19NO — CID 43379643

IUPAC(4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine
SMILESCOc1ccc(C(N)C2CC2C)cc1C
InChIInChI=1S/C13H19NO/c1-8-7-11(8)13(14)10-4-5-12(15-3)9(2)6-10/h4-6,8,11,13H,7,14H2,1-3H3
InChIKeyKONINMASYZAYIV-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.66
Rot. Bonds3

About (4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine

(4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine (PubChem CID 43379643) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is (4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine.

Molecular Properties

Compound Name(4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine
PubChem CID43379643
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name(4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine
SMILESCOc1ccc(C(N)C2CC2C)cc1C
InChIInChI=1S/C13H19NO/c1-8-7-11(8)13(14)10-4-5-12(15-3)9(2)6-10/h4-6,8,11,13H,7,14H2,1-3H3
InChIKeyKONINMASYZAYIV-UHFFFAOYSA-N
XLogP2.66
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(R)-cyclobutyl-(4-methoxy-3-methylphenyl)methanamine;hydrochloride
CID 171213709
N-[(4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methyl]ethanamine
CID 43493659
(S)-(4-methoxy-3-methylphenyl)-(oxan-4-yl)methanamine
CID 171244198
1-(4-methoxy-3-methylphenyl)-2,2-dimethylpropan-1-amine
CID 43379636
(4-methoxy-3-methylphenyl)-(2,2,5,5-tetramethyloxolan-3-yl)methanamine
CID 114623396
(1S)-1-(4-methoxy-3-methylphenyl)ethane-1,2-diamine
CID 55278362
(4-methoxy-3-methylphenyl)-(4-methylphenyl)methanamine
CID 43379645
(4-methoxy-3-methylphenyl)-morpholin-2-ylmethanamine
CID 116940973
(1R,2S)-1-amino-1-(4-methoxy-3-methylphenyl)propan-2-ol
CID 96622534
(1S)-2,2,2-trifluoro-1-(4-methoxy-3-methylphenyl)ethanamine
CID 56971873
(3,4-dimethoxyphenyl)-(3,4-dimethylcyclohexyl)methanamine
CID 64739837
(1R)-1-(4-methoxy-3-methylphenyl)-2-methylbutan-1-amine
CID 171213719

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine?
The IUPAC name of (4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine (CID 43379643) is (4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine.
What is the SMILES notation for (4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine?
The canonical SMILES for (4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine is COc1ccc(C(N)C2CC2C)cc1C.
What is the InChIKey of (4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine?
The InChIKey is KONINMASYZAYIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-8-7-11(8)13(14)10-4-5-12(15-3)9(2)6-10/h4-6,8,11,13H,7,14H2,1-3H3.
What are the key properties of (4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine?
(4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine has a molecular weight of 205.30 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-3-methylphenyl)-(2-methylcyclopropyl)methanamine is sourced from PubChem (CID 43379643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).