1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine

C14H20ClNO2 — CID 103556124

IUPAC1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine
SMILESCOc1ccc(C(N)CC2(OC)CCC2)cc1Cl
InChIInChI=1S/C14H20ClNO2/c1-17-13-5-4-10(8-11(13)15)12(16)9-14(18-2)6-3-7-14/h4-5,8,12H,3,6-7,9,16H2,1-2H3
InChIKeyYNJUZDYLQFHUIB-UHFFFAOYSA-N
MW269.77 g/mol
LogP3.31
Rot. Bonds5

About 1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine

1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine (PubChem CID 103556124) has the molecular formula C14H20ClNO2 and a molecular weight of 269.77 g/mol. Its IUPAC name is 1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine.

Molecular Properties

Compound Name1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine
PubChem CID103556124
Molecular FormulaC14H20ClNO2
Molecular Weight269.77 g/mol
Exact Mass269.12
IUPAC Name1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine
SMILESCOc1ccc(C(N)CC2(OC)CCC2)cc1Cl
InChIInChI=1S/C14H20ClNO2/c1-17-13-5-4-10(8-11(13)15)12(16)9-14(18-2)6-3-7-14/h4-5,8,12H,3,6-7,9,16H2,1-2H3
InChIKeyYNJUZDYLQFHUIB-UHFFFAOYSA-N
XLogP3.31
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.77
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine 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-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)-N-methylethanamine
CID 103556153
1-[3-bromo-4-(2-methoxyethoxy)phenyl]-2-(1-methoxycyclobutyl)ethanamine
CID 103556513
2-(1-methoxycyclobutyl)-1-naphthalen-2-ylethanamine
CID 103559265
(2R)-2-amino-2-(3-chloro-4-methoxyphenyl)ethanol
CID 42579768
4-[1-chloro-2-(1-methoxycyclobutyl)ethyl]-1,2-dimethoxybenzene
CID 103557644
1-(3-chloro-4-methoxyphenyl)pentan-1-amine
CID 43130948
[1-(aminomethyl)cyclopropyl]-(3-chloro-4-methoxyphenyl)methanamine
CID 116943351
(1R)-1-(3-chloro-4-methoxyphenyl)but-3-en-1-amine
CID 170896629
1-(4-chloro-3-methoxyphenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine
CID 103559564
3-amino-3-(3-chloro-4-methoxyphenyl)propanoic acid
CID 6484258
1-(2,5-dichloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanol
CID 103557615
1-(3-chloro-4-methoxyphenyl)-2-(2-methoxyphenyl)ethanamine
CID 43318134

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine?
The IUPAC name of 1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine (CID 103556124) is 1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine.
What is the SMILES notation for 1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine?
The canonical SMILES for 1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine is COc1ccc(C(N)CC2(OC)CCC2)cc1Cl.
What is the InChIKey of 1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine?
The InChIKey is YNJUZDYLQFHUIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClNO2/c1-17-13-5-4-10(8-11(13)15)12(16)9-14(18-2)6-3-7-14/h4-5,8,12H,3,6-7,9,16H2,1-2H3.
What are the key properties of 1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine?
1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine has a molecular weight of 269.77 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine is sourced from PubChem (CID 103556124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).