2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide

C16H26N2O — CID 23588121

IUPAC2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide
SMILESCC(C)CN(C(=O)CNCc1ccccc1)C(C)C
InChIInChI=1S/C16H26N2O/c1-13(2)12-18(14(3)4)16(19)11-17-10-15-8-6-5-7-9-15/h5-9,13-14,17H,10-12H2,1-4H3
InChIKeyCRAXFRLKWMFHBX-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.67
Rot. Bonds7

About 2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide

2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide (PubChem CID 23588121) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide
PubChem CID23588121
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide
SMILESCC(C)CN(C(=O)CNCc1ccccc1)C(C)C
InChIInChI=1S/C16H26N2O/c1-13(2)12-18(14(3)4)16(19)11-17-10-15-8-6-5-7-9-15/h5-9,13-14,17H,10-12H2,1-4H3
InChIKeyCRAXFRLKWMFHBX-UHFFFAOYSA-N
XLogP2.67
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(benzylamino)-N,N-diethylacetamide
CID 10857021
2-(benzylamino)-N,N-diphenylacetamide;hydrochloride
CID 68967523
N-benzyl-4-methyl-N-propan-2-ylpentanamide
CID 86978961
N-benzyl-2-methylpropan-1-amine;ethane
CID 142079167
N-benzyl-2-[2-(4-fluorophenyl)ethylamino]-N-propan-2-ylacetamide
CID 109000424
2-(cyclopropylmethylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide;hydrochloride
CID 119730933
2-(3-hydroxyphenyl)-N-(2-methylpropyl)-N-propan-2-ylacetamide
CID 55000494
N-benzyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine
CID 62561843
(2S)-2-[[2-(benzylamino)acetyl]-[(4-chlorophenyl)methyl]amino]-3-phenylpropanoic acid
CID 101045538
2-[benzylcarbamoyl(2-methylpropyl)amino]acetamide
CID 107653133
2-[acetyl(propan-2-yl)amino]-N-benzylacetamide
CID 113158122
N-benzyl-3-(ethylamino)-N-propan-2-ylpropanamide
CID 62833900

Frequently Asked Questions

What is the IUPAC name of 2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide (CID 23588121) is 2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide is CC(C)CN(C(=O)CNCc1ccccc1)C(C)C.
What is the InChIKey of 2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide?
The InChIKey is CRAXFRLKWMFHBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-13(2)12-18(14(3)4)16(19)11-17-10-15-8-6-5-7-9-15/h5-9,13-14,17H,10-12H2,1-4H3.
What are the key properties of 2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide?
2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide has a molecular weight of 262.40 g/mol, XLogP of 2.67, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzylamino)-N-(2-methylpropyl)-N-propan-2-ylacetamide is sourced from PubChem (CID 23588121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).