2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide

C16H24N2O — CID 60719795

IUPAC2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide
SMILESCCC(C)NCC(=O)NC(c1ccccc1)C1CC1
InChIInChI=1S/C16H24N2O/c1-3-12(2)17-11-15(19)18-16(14-9-10-14)13-7-5-4-6-8-13/h4-8,12,14,16-17H,3,9-11H2,1-2H3,(H,18,19)
InChIKeyPFEYSZMBSGWLTA-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.64
Rot. Bonds7

About 2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide

2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide (PubChem CID 60719795) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide
PubChem CID60719795
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide
SMILESCCC(C)NCC(=O)NC(c1ccccc1)C1CC1
InChIInChI=1S/C16H24N2O/c1-3-12(2)17-11-15(19)18-16(14-9-10-14)13-7-5-4-6-8-13/h4-8,12,14,16-17H,3,9-11H2,1-2H3,(H,18,19)
InChIKeyPFEYSZMBSGWLTA-UHFFFAOYSA-N
XLogP2.64
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(butan-2-ylamino)-N-[(1S)-1-phenylethyl]acetamide
CID 63867528
2-[[cyclopropyl(phenyl)methyl]amino]-N-methylacetamide
CID 60712191
[2-[[(S)-cyclopropyl(phenyl)methyl]amino]-2-oxoethyl] acetate
CID 30313916
2-[[2-(butan-2-ylamino)acetyl]amino]-2-cyclopropylacetic acid
CID 62696023
1-[cyclopropyl(phenyl)methyl]-3-(1-hydroxypropan-2-yl)urea
CID 110892838
2-acetamido-N-[2-[[cyclohexyl(phenyl)methyl]amino]-2-oxoethyl]acetamide
CID 51091250
N-[(S)-cyclopropyl-(4-methylphenyl)methyl]-2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]acetamide
CID 95159580
3-amino-N-[cyclopentyl(phenyl)methyl]butanamide
CID 119737377
2-(butan-2-ylamino)-N-(3,3-dimethyl-1-phenylbutyl)acetamide
CID 60853926
N-[(R)-cyclopropyl(phenyl)methyl]-2-[[(2S,3R)-3-(4-methylpyrazol-1-yl)butan-2-yl]amino]acetamide
CID 95759677
2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide
CID 114007934
3-amino-N-[cyclopropyl(phenyl)methyl]-2-methylpropanamide
CID 62671204

Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide?
The IUPAC name of 2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide (CID 60719795) is 2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide.
What is the SMILES notation for 2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide?
The canonical SMILES for 2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide is CCC(C)NCC(=O)NC(c1ccccc1)C1CC1.
What is the InChIKey of 2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide?
The InChIKey is PFEYSZMBSGWLTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-3-12(2)17-11-15(19)18-16(14-9-10-14)13-7-5-4-6-8-13/h4-8,12,14,16-17H,3,9-11H2,1-2H3,(H,18,19).
What are the key properties of 2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide?
2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide has a molecular weight of 260.38 g/mol, XLogP of 2.64, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide is sourced from PubChem (CID 60719795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).