N,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide

C14H22N2O — CID 63011400

IUPACN,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide
SMILESCC(Cc1ccccc1)NCCC(=O)N(C)C
InChIInChI=1S/C14H22N2O/c1-12(11-13-7-5-4-6-8-13)15-10-9-14(17)16(2)3/h4-8,12,15H,9-11H2,1-3H3
InChIKeyDEFAPAYCRFMPEN-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.69
Rot. Bonds6

About N,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide

N,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide (PubChem CID 63011400) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide.

Molecular Properties

Compound NameN,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide
PubChem CID63011400
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide
SMILESCC(Cc1ccccc1)NCCC(=O)N(C)C
InChIInChI=1S/C14H22N2O/c1-12(11-13-7-5-4-6-8-13)15-10-9-14(17)16(2)3/h4-8,12,15H,9-11H2,1-3H3
InChIKeyDEFAPAYCRFMPEN-UHFFFAOYSA-N
XLogP1.69
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide?
The IUPAC name of N,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide (CID 63011400) is N,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide.
What is the SMILES notation for N,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide?
The canonical SMILES for N,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide is CC(Cc1ccccc1)NCCC(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide?
The InChIKey is DEFAPAYCRFMPEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-12(11-13-7-5-4-6-8-13)15-10-9-14(17)16(2)3/h4-8,12,15H,9-11H2,1-3H3.
What are the key properties of N,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide?
N,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide has a molecular weight of 234.34 g/mol, XLogP of 1.69, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(1-phenylpropan-2-ylamino)propanamide is sourced from PubChem (CID 63011400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).