3-(ethylamino)-N-(2-phenylpropyl)butanamide

C15H24N2O — CID 62839621

IUPAC3-(ethylamino)-N-(2-phenylpropyl)butanamide
SMILESCCNC(C)CC(=O)NCC(C)c1ccccc1
InChIInChI=1S/C15H24N2O/c1-4-16-13(3)10-15(18)17-11-12(2)14-8-6-5-7-9-14/h5-9,12-13,16H,4,10-11H2,1-3H3,(H,17,18)
InChIKeyRBBXYTRRJPCJQG-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.29
Rot. Bonds7

About 3-(ethylamino)-N-(2-phenylpropyl)butanamide

3-(ethylamino)-N-(2-phenylpropyl)butanamide (PubChem CID 62839621) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 3-(ethylamino)-N-(2-phenylpropyl)butanamide.

Molecular Properties

Compound Name3-(ethylamino)-N-(2-phenylpropyl)butanamide
PubChem CID62839621
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name3-(ethylamino)-N-(2-phenylpropyl)butanamide
SMILESCCNC(C)CC(=O)NCC(C)c1ccccc1
InChIInChI=1S/C15H24N2O/c1-4-16-13(3)10-15(18)17-11-12(2)14-8-6-5-7-9-14/h5-9,12-13,16H,4,10-11H2,1-3H3,(H,17,18)
InChIKeyRBBXYTRRJPCJQG-UHFFFAOYSA-N
XLogP2.29
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2R)-2-(ethylamino)propyl]-3,3-diphenylpropanamide;hydrochloride
CID 120652570
N-[(2R)-2-(ethylamino)propyl]-4-methyl-3-phenylpentanamide
CID 120654213
3-amino-3-phenyl-N-(2-phenylpropyl)propanamide
CID 61253056
2-iodo-N-(2-phenylpropyl)acetamide
CID 64787373
2-ethoxy-N-(2-phenylpropyl)acetamide
CID 60637427
3-[3-(ethylamino)butanoylamino]-2-methylpropanoic acid
CID 62833119
3-(ethylamino)-N-(3-phenylpropyl)butanamide
CID 62839193
2-(azetidin-3-yl)-N-(2-phenylpropyl)acetamide
CID 64611219
4-[3-(ethylamino)butanoylamino]-3-methylbutanoic acid
CID 81073006
2-phenyl-3-(3-phenylbutanoylamino)propanoic acid
CID 119254594
2-[[2-oxo-2-(2-phenylpropylamino)ethyl]amino]acetic acid
CID 43465997
2-(ethylamino)-2-methyl-N-(2-phenylpropyl)propanamide
CID 62834242

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-N-(2-phenylpropyl)butanamide?
The IUPAC name of 3-(ethylamino)-N-(2-phenylpropyl)butanamide (CID 62839621) is 3-(ethylamino)-N-(2-phenylpropyl)butanamide.
What is the SMILES notation for 3-(ethylamino)-N-(2-phenylpropyl)butanamide?
The canonical SMILES for 3-(ethylamino)-N-(2-phenylpropyl)butanamide is CCNC(C)CC(=O)NCC(C)c1ccccc1.
What is the InChIKey of 3-(ethylamino)-N-(2-phenylpropyl)butanamide?
The InChIKey is RBBXYTRRJPCJQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-16-13(3)10-15(18)17-11-12(2)14-8-6-5-7-9-14/h5-9,12-13,16H,4,10-11H2,1-3H3,(H,17,18).
What are the key properties of 3-(ethylamino)-N-(2-phenylpropyl)butanamide?
3-(ethylamino)-N-(2-phenylpropyl)butanamide has a molecular weight of 248.37 g/mol, XLogP of 2.29, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-N-(2-phenylpropyl)butanamide is sourced from PubChem (CID 62839621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).