2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine

C12H17NO2 — CID 62387494

IUPAC2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine
SMILESCOc1ccc(C2(C)CC2N)cc1OC
InChIInChI=1S/C12H17NO2/c1-12(7-11(12)13)8-4-5-9(14-2)10(6-8)15-3/h4-6,11H,7,13H2,1-3H3
InChIKeyICKYTWQGPZGDGR-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.69
Rot. Bonds3

About 2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine

2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine (PubChem CID 62387494) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine
PubChem CID62387494
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine
SMILESCOc1ccc(C2(C)CC2N)cc1OC
InChIInChI=1S/C12H17NO2/c1-12(7-11(12)13)8-4-5-9(14-2)10(6-8)15-3/h4-6,11H,7,13H2,1-3H3
InChIKeyICKYTWQGPZGDGR-UHFFFAOYSA-N
XLogP1.69
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine
CID 62389721
2-(3-methoxyphenyl)-2-methylcyclopropan-1-amine
CID 62389909
1-(3,4-dimethoxyphenyl)-2-ethylcyclopropan-1-amine
CID 79333872
4-(1-tert-butylcyclopropyl)-1,2-dimethoxybenzene
CID 58988277
1-(3,4-dimethoxyphenyl)-3-methoxycyclobutan-1-ol
CID 106823852
cis-(1S,2R)-2-(4-bromophenyl)-2-methylcyclopropan-1-amine
CID 94419650
4-[(2R)-2-amino-1-methylcyclopropyl]phenol
CID 105432218
2-[1-(3,4-dimethoxyphenyl)cyclopropyl]propan-2-amine
CID 83673806
1-(3,4-dimethoxyphenyl)-2,2-dimethylcyclopropane-1-carbonitrile
CID 116842265
3-(3,4-dimethoxyphenyl)-3-methyl-5-oxopyrrolidine-2-carboxylic acid
CID 105359949
1-(3,4-dimethoxyphenyl)-4,4-dimethylcycloheptan-1-amine
CID 65084119
[1-(3,4-dimethoxyphenyl)cyclopentyl]methanol
CID 13128207

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine (CID 62387494) is 2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine is COc1ccc(C2(C)CC2N)cc1OC.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine?
The InChIKey is ICKYTWQGPZGDGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-12(7-11(12)13)8-4-5-9(14-2)10(6-8)15-3/h4-6,11H,7,13H2,1-3H3.
What are the key properties of 2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine?
2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine has a molecular weight of 207.27 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine is sourced from PubChem (CID 62387494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).