N-(cyclopropylmethyl)-3-phenylpropanamide

C13H17NO — CID 51076426

IUPACN-(cyclopropylmethyl)-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NCC1CC1
InChIInChI=1S/C13H17NO/c15-13(14-10-12-6-7-12)9-8-11-4-2-1-3-5-11/h1-5,12H,6-10H2,(H,14,15)
InChIKeyBAPRQQJKPWHXAE-UHFFFAOYSA-N
MW203.29 g/mol
LogP2.15
Rot. Bonds5

About N-(cyclopropylmethyl)-3-phenylpropanamide

N-(cyclopropylmethyl)-3-phenylpropanamide (PubChem CID 51076426) has the molecular formula C13H17NO and a molecular weight of 203.29 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-3-phenylpropanamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-3-phenylpropanamide
PubChem CID51076426
Molecular FormulaC13H17NO
Molecular Weight203.29 g/mol
Exact Mass203.13
IUPAC NameN-(cyclopropylmethyl)-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NCC1CC1
InChIInChI=1S/C13H17NO/c15-13(14-10-12-6-7-12)9-8-11-4-2-1-3-5-11/h1-5,12H,6-10H2,(H,14,15)
InChIKeyBAPRQQJKPWHXAE-UHFFFAOYSA-N
XLogP2.15
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(3-hydroxycyclopentyl)methyl]-3-phenylpropanamide
CID 103279802
3-(4-aminophenyl)-N-(cyclopropylmethyl)propanamide
CID 43309173
N,N-dimethyl-4-[(3-phenylpropanoylamino)methyl]piperidine-1-carboxamide
CID 119103247
4-[(3-pyridin-4-ylpropanoylamino)methyl]cyclohexane-1-carboxylic acid
CID 104963619
N-[(4-chlorocyclohexyl)methyl]-2-phenylacetamide
CID 114147876
3-(4-aminophenyl)-N-(cyclopentylmethyl)propanamide
CID 43371351
3-phenyl-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]propanamide
CID 16895855
N-[(4-bromocyclohexyl)methyl]-2-phenylacetamide
CID 106134234
3-phenyl-N-[[4-(2H-pyrazolo[3,4-b]pyrazin-3-yl)cyclohexyl]methyl]propanamide
CID 98074501
N-(cyclopropylmethyl)-3-phenylsulfanylpropanamide
CID 51076427
N-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide
CID 66004709
N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride
CID 146064790

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-3-phenylpropanamide?
The IUPAC name of N-(cyclopropylmethyl)-3-phenylpropanamide (CID 51076426) is N-(cyclopropylmethyl)-3-phenylpropanamide.
What is the SMILES notation for N-(cyclopropylmethyl)-3-phenylpropanamide?
The canonical SMILES for N-(cyclopropylmethyl)-3-phenylpropanamide is O=C(CCc1ccccc1)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-3-phenylpropanamide?
The InChIKey is BAPRQQJKPWHXAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c15-13(14-10-12-6-7-12)9-8-11-4-2-1-3-5-11/h1-5,12H,6-10H2,(H,14,15).
What are the key properties of N-(cyclopropylmethyl)-3-phenylpropanamide?
N-(cyclopropylmethyl)-3-phenylpropanamide has a molecular weight of 203.29 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-3-phenylpropanamide is sourced from PubChem (CID 51076426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).