N-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide

C16H24N2O — CID 54925148

IUPACN-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide
SMILESCCC(C)NCC(=O)N(Cc1ccccc1)C1CC1
InChIInChI=1S/C16H24N2O/c1-3-13(2)17-11-16(19)18(15-9-10-15)12-14-7-5-4-6-8-14/h4-8,13,15,17H,3,9-12H2,1-2H3
InChIKeyUDIRSDHCKGEWLO-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.57
Rot. Bonds7

About N-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide

N-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide (PubChem CID 54925148) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide.

Molecular Properties

Compound NameN-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide
PubChem CID54925148
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide
SMILESCCC(C)NCC(=O)N(Cc1ccccc1)C1CC1
InChIInChI=1S/C16H24N2O/c1-3-13(2)17-11-16(19)18(15-9-10-15)12-14-7-5-4-6-8-14/h4-8,13,15,17H,3,9-12H2,1-2H3
InChIKeyUDIRSDHCKGEWLO-UHFFFAOYSA-N
XLogP2.57
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-2-[1-(2-chlorophenyl)ethylamino]-N-cyclopropylacetamide
CID 78896142
(2S,3S)-2-[[2-[cyclopropyl-[(4-methylphenyl)methyl]amino]-2-oxoethyl]amino]-3-methylpentanoic acid
CID 122100128
2-(butan-2-ylamino)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]acetamide
CID 60938567
N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide
CID 60846421
2-anilino-N-benzyl-N-cyclopropylacetamide;hydrochloride
CID 119703213
N-cyclopropyl-2-(propan-2-ylamino)-N-(pyridin-4-ylmethyl)acetamide
CID 54869747
N-benzyl-N-cyclopropyl-3,3-diphenylpropanamide
CID 55549162
2-(butan-2-ylamino)-N-cyclohexyl-N-ethylacetamide
CID 60684282
N-benzyl-2-bromo-N-cyclopropylbutanamide
CID 62856125
N-benzyl-N-cyclopropyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 78924228
N-benzyl-N-cyclopropyl-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119703228
2-[[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]amino]-3-methylbutanoic acid
CID 43468491

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide?
The IUPAC name of N-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide (CID 54925148) is N-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide.
What is the SMILES notation for N-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide?
The canonical SMILES for N-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide is CCC(C)NCC(=O)N(Cc1ccccc1)C1CC1.
What is the InChIKey of N-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide?
The InChIKey is UDIRSDHCKGEWLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-3-13(2)17-11-16(19)18(15-9-10-15)12-14-7-5-4-6-8-14/h4-8,13,15,17H,3,9-12H2,1-2H3.
What are the key properties of N-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide?
N-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide has a molecular weight of 260.38 g/mol, XLogP of 2.57, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide is sourced from PubChem (CID 54925148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).