2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide

C16H24N2O — CID 119766334

IUPAC2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide
SMILESCCC(Cc1ccccc1)NC(=O)CNCC1CC1
InChIInChI=1S/C16H24N2O/c1-2-15(10-13-6-4-3-5-7-13)18-16(19)12-17-11-14-8-9-14/h3-7,14-15,17H,2,8-12H2,1H3,(H,18,19)
InChIKeyZQNGWXNIZONXFY-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.12
Rot. Bonds8

About 2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide

2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide (PubChem CID 119766334) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide
PubChem CID119766334
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide
SMILESCCC(Cc1ccccc1)NC(=O)CNCC1CC1
InChIInChI=1S/C16H24N2O/c1-2-15(10-13-6-4-3-5-7-13)18-16(19)12-17-11-14-8-9-14/h3-7,14-15,17H,2,8-12H2,1H3,(H,18,19)
InChIKeyZQNGWXNIZONXFY-UHFFFAOYSA-N
XLogP2.12
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclopropylmethylamino)-N-(1-phenylhexan-3-yl)acetamide
CID 119802845
2-(methylamino)-N-(1-phenylbutan-2-yl)acetamide
CID 119766326
2-(cyclopropylmethylamino)-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)acetamide
CID 119883220
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylbutan-2-yl)acetamide;hydrochloride
CID 119766335
methyl N-[(2S)-1-phenylbutan-2-yl]carbamate
CID 118461048
N-(1-phenylbutan-2-yl)acetamide
CID 2826983
N-[(2R)-1-phenylbutan-2-yl]acetamide
CID 778652
2-(3-ethoxycyclobutyl)-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]acetamide
CID 107861181
2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride
CID 119762010
[(2S)-1-phenylbutan-2-yl]urea
CID 7452634
2-hydroxy-N-(1-phenylbutan-2-yl)cyclopentane-1-carboxamide
CID 110015652
2-(cyclopropylmethylamino)-N-[1-(3-methylthiophen-2-yl)-2-phenylethyl]acetamide;hydrochloride
CID 119792182

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide (CID 119766334) is 2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide is CCC(Cc1ccccc1)NC(=O)CNCC1CC1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide?
The InChIKey is ZQNGWXNIZONXFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-15(10-13-6-4-3-5-7-13)18-16(19)12-17-11-14-8-9-14/h3-7,14-15,17H,2,8-12H2,1H3,(H,18,19).
What are the key properties of 2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide?
2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide has a molecular weight of 260.38 g/mol, XLogP of 2.12, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-(1-phenylbutan-2-yl)acetamide is sourced from PubChem (CID 119766334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).