N-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide

C14H19NO — CID 70274556

IUPACN-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide
SMILESCCc1cccc(C2(CNC(C)=O)CC2)c1
InChIInChI=1S/C14H19NO/c1-3-12-5-4-6-13(9-12)14(7-8-14)10-15-11(2)16/h4-6,9H,3,7-8,10H2,1-2H3,(H,15,16)
InChIKeyGOGVPKJDBNINNC-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.42
Rot. Bonds4

About N-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide

N-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide (PubChem CID 70274556) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is N-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide
PubChem CID70274556
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC NameN-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide
SMILESCCc1cccc(C2(CNC(C)=O)CC2)c1
InChIInChI=1S/C14H19NO/c1-3-12-5-4-6-13(9-12)14(7-8-14)10-15-11(2)16/h4-6,9H,3,7-8,10H2,1-2H3,(H,15,16)
InChIKeyGOGVPKJDBNINNC-UHFFFAOYSA-N
XLogP2.42
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[1-(3-chlorophenyl)cyclopropyl]methyl]propanamide
CID 110441339
3-acetamido-N-[[1-(3-chlorophenyl)cyclopropyl]methyl]benzamide
CID 110439910
N-[[1-(3-fluorophenyl)cyclopropyl]methyl]pentanamide
CID 110479509
3-oxo-N-[(1-phenylcyclopropyl)methyl]butanamide
CID 110470652
N-[[1-(3-chlorophenyl)cyclopropyl]methyl]furan-2-carboxamide
CID 110443400
1-[[1-(3-bromophenyl)cyclopropyl]methyl]-3-methoxyurea
CID 56805862
3,5-diacetamido-N-[(1-phenylcyclopropyl)methyl]benzamide
CID 51111712
N-[[1-(2,6-difluorophenyl)cyclopentyl]methyl]acetamide
CID 154775614
3-[3-[1-(hydroxymethyl)cyclopropyl]phenyl]-2-methylpropanoic acid
CID 115112846
methyl 3-[1-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclopropyl]benzoate
CID 166172399
1-ethyl-3-(1-phenylcyclopropyl)benzene
CID 142848757
N-[[1-(3-chlorophenyl)cyclopropyl]methyl]-2-(methylamino)acetamide;hydrochloride
CID 119799732

Frequently Asked Questions

What is the IUPAC name of N-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide?
The IUPAC name of N-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide (CID 70274556) is N-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide.
What is the SMILES notation for N-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide?
The canonical SMILES for N-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide is CCc1cccc(C2(CNC(C)=O)CC2)c1.
What is the InChIKey of N-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide?
The InChIKey is GOGVPKJDBNINNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-3-12-5-4-6-13(9-12)14(7-8-14)10-15-11(2)16/h4-6,9H,3,7-8,10H2,1-2H3,(H,15,16).
What are the key properties of N-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide?
N-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide has a molecular weight of 217.31 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(3-ethylphenyl)cyclopropyl]methyl]acetamide is sourced from PubChem (CID 70274556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).