N-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide

C12H15NO2 — CID 110902492

IUPACN-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide
SMILESO=C(NCc1ccccc1CO)C1CC1
InChIInChI=1S/C12H15NO2/c14-8-11-4-2-1-3-10(11)7-13-12(15)9-5-6-9/h1-4,9,14H,5-8H2,(H,13,15)
InChIKeyGSVVIJYYSDKGCX-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.21
Rot. Bonds4

About N-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide

N-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide (PubChem CID 110902492) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is N-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide
PubChem CID110902492
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC NameN-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide
SMILESO=C(NCc1ccccc1CO)C1CC1
InChIInChI=1S/C12H15NO2/c14-8-11-4-2-1-3-10(11)7-13-12(15)9-5-6-9/h1-4,9,14H,5-8H2,(H,13,15)
InChIKeyGSVVIJYYSDKGCX-UHFFFAOYSA-N
XLogP1.21
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(aminomethyl)phenyl]methyl]cyclopropanecarboxamide
CID 62952159
N-[(2-chlorophenyl)methyl]cyclopropanecarboxamide
CID 899098
(3S)-N-[[2-(hydroxymethyl)phenyl]methyl]piperidine-3-carboxamide
CID 124591380
2-[2-[[(4-aminocyclohexanecarbonyl)amino]methyl]phenyl]acetic acid
CID 81313103
N-[(2-hydroxyphenyl)methyl]cyclopentanecarboxamide
CID 110470991
N-[[2-(hydroxymethyl)phenyl]methyl]piperidine-2-carboxamide
CID 126781786
N-[(2-fluorophenyl)methyl]-4-(hydroxymethyl)cyclohexane-1-carboxamide
CID 115151204
N-[(2-chlorophenyl)methyl]cyclobutanecarboxamide
CID 17173308
N-[[2-(hydroxymethyl)phenyl]methyl]-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide
CID 135337016
N-benzyl-4-hydroxycyclohexane-1-carboxamide
CID 21217684
3-[(2-hydroxyphenyl)methylcarbamoyl]cyclopentane-1-carboxylic acid
CID 103551256
4-N-[(2-methylphenyl)methyl]-1-N-(pyridin-4-ylmethyl)cyclohexane-1,4-dicarboxamide
CID 109147996

Frequently Asked Questions

What is the IUPAC name of N-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide?
The IUPAC name of N-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide (CID 110902492) is N-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide?
The canonical SMILES for N-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide is O=C(NCc1ccccc1CO)C1CC1.
What is the InChIKey of N-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide?
The InChIKey is GSVVIJYYSDKGCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c14-8-11-4-2-1-3-10(11)7-13-12(15)9-5-6-9/h1-4,9,14H,5-8H2,(H,13,15).
What are the key properties of N-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide?
N-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide has a molecular weight of 205.26 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide is sourced from PubChem (CID 110902492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).