[1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone

C11H13NO2 — CID 105444935

IUPAC[1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone
SMILESNCC1(C(=O)c2ccccc2O)CC1
InChIInChI=1S/C11H13NO2/c12-7-11(5-6-11)10(14)8-3-1-2-4-9(8)13/h1-4,13H,5-7,12H2
InChIKeyFEZRAYDHSJPOBX-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.31
Rot. Bonds3

About [1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone

[1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone (PubChem CID 105444935) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is [1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone.

Molecular Properties

Compound Name[1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone
PubChem CID105444935
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Name[1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone
SMILESNCC1(C(=O)c2ccccc2O)CC1
InChIInChI=1S/C11H13NO2/c12-7-11(5-6-11)10(14)8-3-1-2-4-9(8)13/h1-4,13H,5-7,12H2
InChIKeyFEZRAYDHSJPOBX-UHFFFAOYSA-N
XLogP1.31
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1-aminocyclopropyl)-(2-hydroxyphenyl)methanone
CID 105436807
[1-(aminomethyl)cyclohexyl]-naphthalen-1-ylmethanone
CID 116600777
[1-(aminomethyl)cyclobutyl]-phenylmethanone
CID 116600332
[1-(aminomethyl)cyclobutyl]-(2,3-dimethylphenyl)methanone
CID 116600303
[1-(aminomethyl)cyclohexyl]-(2-propan-2-yloxyphenyl)methanone
CID 116600547
[4-(aminomethyl)oxan-4-yl]-(2,3-dichlorophenyl)methanone
CID 116603072
[3-(aminomethyl)oxetan-3-yl]-naphthalen-1-ylmethanone
CID 116922800
[1-(aminomethyl)cyclopropyl]-(4-methylphenyl)methanone
CID 116601146
[1-(aminomethyl)cyclopentyl]-(1-benzothiophen-7-yl)methanone
CID 116600912
[1-(aminomethyl)cycloheptyl]-quinolin-8-ylmethanone
CID 116602174
[1-(aminomethyl)cyclopropyl]-(5-chloro-2-methoxyphenyl)methanone
CID 116601328
[1-(aminomethyl)cyclopropyl]-(2-chloro-4-methoxyphenyl)methanone
CID 116921260

Frequently Asked Questions

What is the IUPAC name of [1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone?
The IUPAC name of [1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone (CID 105444935) is [1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone.
What is the SMILES notation for [1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone?
The canonical SMILES for [1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone is NCC1(C(=O)c2ccccc2O)CC1.
What is the InChIKey of [1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone?
The InChIKey is FEZRAYDHSJPOBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c12-7-11(5-6-11)10(14)8-3-1-2-4-9(8)13/h1-4,13H,5-7,12H2.
What are the key properties of [1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone?
[1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone has a molecular weight of 191.23 g/mol, XLogP of 1.31, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(aminomethyl)cyclopropyl]-(2-hydroxyphenyl)methanone is sourced from PubChem (CID 105444935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).