1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine

C13H19NO2 — CID 43560073

IUPAC1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine
SMILESCNCc1cc(OC)ccc1OCC1CC1
InChIInChI=1S/C13H19NO2/c1-14-8-11-7-12(15-2)5-6-13(11)16-9-10-3-4-10/h5-7,10,14H,3-4,8-9H2,1-2H3
InChIKeyZNRCYVASUFREQN-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.20
Rot. Bonds6

About 1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine

1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine (PubChem CID 43560073) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine
PubChem CID43560073
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine
SMILESCNCc1cc(OC)ccc1OCC1CC1
InChIInChI=1S/C13H19NO2/c1-14-8-11-7-12(15-2)5-6-13(11)16-9-10-3-4-10/h5-7,10,14H,3-4,8-9H2,1-2H3
InChIKeyZNRCYVASUFREQN-UHFFFAOYSA-N
XLogP2.20
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-ethoxy-5-methoxyphenyl)-N-methylmethanamine
CID 43276259
N-[[2-(cyclopentylmethoxy)-5-methoxyphenyl]methyl]propan-1-amine
CID 61342420
1-[2-(2-bicyclo[2.2.1]heptanylmethoxy)-5-methoxyphenyl]-N-methylmethanamine
CID 79554576
N-[[2-(cyclopentylmethoxy)-5-methoxyphenyl]methyl]-2-methylpropan-1-amine
CID 63500325
1-[2-(3,3-dimethylbutoxy)-5-methoxyphenyl]-N-methylmethanamine
CID 54957615
2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine
CID 61343767
1-[6-(cyclopropylmethoxy)-1,3-benzodioxol-5-yl]-N-methylmethanamine
CID 55011820
N-methyl-1-[5-methyl-2-(oxan-4-ylmethoxy)phenyl]methanamine
CID 55204163
1-[5-methoxy-2-(4-methylcyclohexyl)oxyphenyl]-N-methylmethanamine
CID 64748456
1-[5-methoxy-2-[3-(oxolan-2-yl)propoxy]phenyl]-N-methylmethanamine
CID 65158967
1-(2-but-2-ynoxy-5-methoxyphenyl)-N-methylmethanamine
CID 62311325
1-[5-methoxy-2-(2-pyrrolidin-1-ylethoxy)phenyl]-N-methylmethanamine
CID 60878143

Frequently Asked Questions

What is the IUPAC name of 1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine?
The IUPAC name of 1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine (CID 43560073) is 1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine is CNCc1cc(OC)ccc1OCC1CC1.
What is the InChIKey of 1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine?
The InChIKey is ZNRCYVASUFREQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-14-8-11-7-12(15-2)5-6-13(11)16-9-10-3-4-10/h5-7,10,14H,3-4,8-9H2,1-2H3.
What are the key properties of 1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine?
1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine has a molecular weight of 221.30 g/mol, XLogP of 2.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine is sourced from PubChem (CID 43560073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).