2-(butan-2-ylamino)-N-[1-(2-chlorophenyl)propan-2-yl]acetamide

C15H23ClN2O — CID 60853929

IUPAC2-(butan-2-ylamino)-N-[1-(2-chlorophenyl)propan-2-yl]acetamide
SMILESCCC(C)NCC(=O)NC(C)Cc1ccccc1Cl
InChIInChI=1S/C15H23ClN2O/c1-4-11(2)17-10-15(19)18-12(3)9-13-7-5-6-8-14(13)16/h5-8,11-12,17H,4,9-10H2,1-3H3,(H,18,19)
InChIKeyMCFFVLMARUQBOY-UHFFFAOYSA-N
MW282.81 g/mol
LogP2.78
Rot. Bonds7

About 2-(butan-2-ylamino)-N-[1-(2-chlorophenyl)propan-2-yl]acetamide

2-(butan-2-ylamino)-N-[1-(2-chlorophenyl)propan-2-yl]acetamide (PubChem CID 60853929) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-N-[1-(2-chlorophenyl)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-(butan-2-ylamino)-N-[1-(2-chlorophenyl)propan-2-yl]acetamide
PubChem CID60853929
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC Name2-(butan-2-ylamino)-N-[1-(2-chlorophenyl)propan-2-yl]acetamide
SMILESCCC(C)NCC(=O)NC(C)Cc1ccccc1Cl
InChIInChI=1S/C15H23ClN2O/c1-4-11(2)17-10-15(19)18-12(3)9-13-7-5-6-8-14(13)16/h5-8,11-12,17H,4,9-10H2,1-3H3,(H,18,19)
InChIKeyMCFFVLMARUQBOY-UHFFFAOYSA-N
XLogP2.78
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(aminomethyl)-N-[1-(2-chlorophenyl)propan-2-yl]pentanamide
CID 81075633
(2S)-2-amino-N-[1-(2-chlorophenyl)propan-2-yl]butanamide
CID 79025472
4-acetyl-N-[1-(2-chlorophenyl)propan-2-yl]piperazine-1-carboxamide
CID 110675407
N-[1-(2-chlorophenyl)propan-2-yl]pyrrolidine-1-carboxamide
CID 110675397
N-butan-2-yl-2-[(2-chlorophenyl)methylsulfanyl]acetamide
CID 2889769
N-[1-(2-chlorophenyl)propan-2-yl]-2-(3-fluorophenyl)acetamide
CID 42961637
1-(2-chlorophenyl)-N-ethylpropan-2-amine
CID 43677539
ethyl 4-[1-(2-chlorophenyl)propan-2-ylcarbamoyl]piperazine-1-carboxylate
CID 110675422
3-[[2-(2-chlorophenyl)acetyl]amino]butanoic acid
CID 43240713
2-[[(2S)-butan-2-yl]amino]-N-(2-chloro-6-methylphenyl)acetamide
CID 124514697
(2S)-2-amino-N-[1-(2-chlorophenyl)propan-2-yl]-4-methylpentanamide
CID 61156026
tert-butyl N-[1-(2-chlorophenyl)propan-2-yl]carbamate
CID 63789387

Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-N-[1-(2-chlorophenyl)propan-2-yl]acetamide?
The IUPAC name of 2-(butan-2-ylamino)-N-[1-(2-chlorophenyl)propan-2-yl]acetamide (CID 60853929) is 2-(butan-2-ylamino)-N-[1-(2-chlorophenyl)propan-2-yl]acetamide.
What is the SMILES notation for 2-(butan-2-ylamino)-N-[1-(2-chlorophenyl)propan-2-yl]acetamide?
The canonical SMILES for 2-(butan-2-ylamino)-N-[1-(2-chlorophenyl)propan-2-yl]acetamide is CCC(C)NCC(=O)NC(C)Cc1ccccc1Cl.
What is the InChIKey of 2-(butan-2-ylamino)-N-[1-(2-chlorophenyl)propan-2-yl]acetamide?
The InChIKey is MCFFVLMARUQBOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClN2O/c1-4-11(2)17-10-15(19)18-12(3)9-13-7-5-6-8-14(13)16/h5-8,11-12,17H,4,9-10H2,1-3H3,(H,18,19).
What are the key properties of 2-(butan-2-ylamino)-N-[1-(2-chlorophenyl)propan-2-yl]acetamide?
2-(butan-2-ylamino)-N-[1-(2-chlorophenyl)propan-2-yl]acetamide has a molecular weight of 282.81 g/mol, XLogP of 2.78, 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-[1-(2-chlorophenyl)propan-2-yl]acetamide is sourced from PubChem (CID 60853929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).