[1-(3-methoxyphenoxy)cyclopropyl]methanamine

C11H15NO2 — CID 83920742

IUPAC[1-(3-methoxyphenoxy)cyclopropyl]methanamine
SMILESCOc1cccc(OC2(CN)CC2)c1
InChIInChI=1S/C11H15NO2/c1-13-9-3-2-4-10(7-9)14-11(8-12)5-6-11/h2-4,7H,5-6,8,12H2,1H3
InChIKeyGMBQNPQKWJCQMQ-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.57
Rot. Bonds4

About [1-(3-methoxyphenoxy)cyclopropyl]methanamine

[1-(3-methoxyphenoxy)cyclopropyl]methanamine (PubChem CID 83920742) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is [1-(3-methoxyphenoxy)cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(3-methoxyphenoxy)cyclopropyl]methanamine
PubChem CID83920742
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name[1-(3-methoxyphenoxy)cyclopropyl]methanamine
SMILESCOc1cccc(OC2(CN)CC2)c1
InChIInChI=1S/C11H15NO2/c1-13-9-3-2-4-10(7-9)14-11(8-12)5-6-11/h2-4,7H,5-6,8,12H2,1H3
InChIKeyGMBQNPQKWJCQMQ-UHFFFAOYSA-N
XLogP1.57
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(3-methylphenoxy)cyclopropyl]methanamine
CID 83920734
[1-(3,5-dimethoxyphenoxy)cyclopentyl]methanamine
CID 94690530
[1-(3-ethoxyphenoxy)cyclohexyl]methanamine
CID 94689943
N-[[1-(3-methoxyphenoxy)cyclopropyl]methyl]-2-methylpropan-1-amine
CID 114199444
[1-(3-propan-2-ylphenoxy)cyclohexyl]methanamine
CID 82131016
[1-(4-chloro-3-methylphenoxy)cyclopropyl]methanamine
CID 126973987
CID 172849383
CID 172849383
azane;1,3-dimethoxybenzene
CID 70210283
tris(1,3-dimethoxybenzene);phosphane
CID 160853878
[5-(3-methoxyphenyl)spiro[2.3]hexan-5-yl]methanamine
CID 65008436
N-[1-(aminomethyl)cyclopropyl]-3-methoxy-N-methylaniline
CID 106661172
carbanide;1,3-dimethoxybenzene;rubidium(1+)
CID 160752391

Frequently Asked Questions

What is the IUPAC name of [1-(3-methoxyphenoxy)cyclopropyl]methanamine?
The IUPAC name of [1-(3-methoxyphenoxy)cyclopropyl]methanamine (CID 83920742) is [1-(3-methoxyphenoxy)cyclopropyl]methanamine.
What is the SMILES notation for [1-(3-methoxyphenoxy)cyclopropyl]methanamine?
The canonical SMILES for [1-(3-methoxyphenoxy)cyclopropyl]methanamine is COc1cccc(OC2(CN)CC2)c1.
What is the InChIKey of [1-(3-methoxyphenoxy)cyclopropyl]methanamine?
The InChIKey is GMBQNPQKWJCQMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-13-9-3-2-4-10(7-9)14-11(8-12)5-6-11/h2-4,7H,5-6,8,12H2,1H3.
What are the key properties of [1-(3-methoxyphenoxy)cyclopropyl]methanamine?
[1-(3-methoxyphenoxy)cyclopropyl]methanamine has a molecular weight of 193.25 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-methoxyphenoxy)cyclopropyl]methanamine is sourced from PubChem (CID 83920742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).