N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide

C16H26N2O — CID 146198443

IUPACN-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide
SMILESCN(C)CC(Cc1ccccc1)NC(=O)C(C)(C)C
InChIInChI=1S/C16H26N2O/c1-16(2,3)15(19)17-14(12-18(4)5)11-13-9-7-6-8-10-13/h6-10,14H,11-12H2,1-5H3,(H,17,19)
InChIKeyOOSIDJYSPKPNJI-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.32
Rot. Bonds5

About N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide

N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide (PubChem CID 146198443) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide
PubChem CID146198443
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide
SMILESCN(C)CC(Cc1ccccc1)NC(=O)C(C)(C)C
InChIInChI=1S/C16H26N2O/c1-16(2,3)15(19)17-14(12-18(4)5)11-13-9-7-6-8-10-13/h6-10,14H,11-12H2,1-5H3,(H,17,19)
InChIKeyOOSIDJYSPKPNJI-UHFFFAOYSA-N
XLogP2.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-bis[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]urea
CID 124628917
1-[(2S)-1-(dimethylamino)-3-phenylpropan-2-yl]-3-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]urea
CID 124628915
tert-butyl N-[(2S)-1-(dimethylamino)-3-phenylpropan-2-yl]carbamate
CID 142063959
N-[(2S,5S)-5-(dibenzylamino)-4-oxo-1,6-diphenylhexan-2-yl]-2,2-dimethylpropanamide
CID 57274655
4-amino-N-[1-(dimethylamino)-3-phenylpropan-2-yl]benzamide;hydrochloride
CID 117067649
N-[(1S)-1,2-diphenylethyl]-2,2-dimethylpropanamide
CID 41097241
1-cyclopentyl-3-[1-(dimethylamino)-3-phenylpropan-2-yl]urea
CID 60544383
N-[(2S)-1-(dimethylamino)-3-phenylpropan-2-yl]-2-naphthalen-1-ylacetamide
CID 97195739
1-[1-(dimethylamino)-3-phenylpropan-2-yl]-3-[(4-fluorophenyl)methyl]urea
CID 60544381
2,2-dimethyl-N-[(2R)-3-oxo-1-phenylpentan-2-yl]propanamide
CID 67704235
2-amino-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-methylpropanamide
CID 15660575
N-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide
CID 97313866

Frequently Asked Questions

What is the IUPAC name of N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide?
The IUPAC name of N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide (CID 146198443) is N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide is CN(C)CC(Cc1ccccc1)NC(=O)C(C)(C)C.
What is the InChIKey of N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide?
The InChIKey is OOSIDJYSPKPNJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-16(2,3)15(19)17-14(12-18(4)5)11-13-9-7-6-8-10-13/h6-10,14H,11-12H2,1-5H3,(H,17,19).
What are the key properties of N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide?
N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide has a molecular weight of 262.40 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide is sourced from PubChem (CID 146198443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).