N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide

C16H24N2O2 — CID 119572773

IUPACN-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide
SMILESCOc1ccccc1CCC(=O)NC(C)(CN)C1CC1
InChIInChI=1S/C16H24N2O2/c1-16(11-17,13-8-9-13)18-15(19)10-7-12-5-3-4-6-14(12)20-2/h3-6,13H,7-11,17H2,1-2H3,(H,18,19)
InChIKeyBJUJTLBGPRAIDW-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.87
Rot. Bonds7

About N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide

N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide (PubChem CID 119572773) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide.

Molecular Properties

Compound NameN-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide
PubChem CID119572773
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide
SMILESCOc1ccccc1CCC(=O)NC(C)(CN)C1CC1
InChIInChI=1S/C16H24N2O2/c1-16(11-17,13-8-9-13)18-15(19)10-7-12-5-3-4-6-14(12)20-2/h3-6,13H,7-11,17H2,1-2H3,(H,18,19)
InChIKeyBJUJTLBGPRAIDW-UHFFFAOYSA-N
XLogP1.87
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-bromophenyl)propanamide
CID 119575176
2-cyclopropyl-2-[3-(2-methoxyphenyl)propanoylamino]propanoic acid
CID 43360411
N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-bromophenyl)propanamide;hydrochloride
CID 119575175
N-(1-amino-2-cyclopropylpropan-2-yl)-2-(2,6-dimethoxyphenyl)acetamide;hydrochloride
CID 119574609
N-(1-amino-2-cyclopropylpropan-2-yl)-2-(2-methoxyanilino)acetamide;dihydrochloride
CID 119572973
N-(1-amino-2-cyclopropylpropan-2-yl)-2-(2-propan-2-yloxyphenyl)acetamide
CID 119573037
N-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide
CID 119573701
N-(1-amino-2-cyclopropylpropan-2-yl)-4-(4-methoxyphenoxy)butanamide
CID 119572344
N-(1-amino-2-cyclopropylpropan-2-yl)-2-naphthalen-1-ylacetamide;hydrochloride
CID 119574755
N-[(2S)-2-cyano-3,3-dimethylbutan-2-yl]-3-(2-methoxyphenyl)propanamide
CID 124885091
N-(1-amino-2-cyclopropylpropan-2-yl)-3-(4-methoxyphenyl)sulfanylpropanamide
CID 119572330
N-[2-(aminomethyl)cyclohexyl]-3-(2-methoxyphenyl)propanamide;hydrochloride
CID 119609653

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide?
The IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide (CID 119572773) is N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide.
What is the SMILES notation for N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide?
The canonical SMILES for N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide is COc1ccccc1CCC(=O)NC(C)(CN)C1CC1.
What is the InChIKey of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide?
The InChIKey is BJUJTLBGPRAIDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-16(11-17,13-8-9-13)18-15(19)10-7-12-5-3-4-6-14(12)20-2/h3-6,13H,7-11,17H2,1-2H3,(H,18,19).
What are the key properties of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide?
N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide has a molecular weight of 276.38 g/mol, XLogP of 1.87, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-methoxyphenyl)propanamide is sourced from PubChem (CID 119572773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).