2-[ethyl(propyl)amino]-1-phenylethanone

C13H19NO — CID 43795306

IUPAC2-[ethyl(propyl)amino]-1-phenylethanone
SMILESCCCN(CC)CC(=O)c1ccccc1
InChIInChI=1S/C13H19NO/c1-3-10-14(4-2)11-13(15)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
InChIKeyRXQRXAXZMVBXHZ-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.60
Rot. Bonds6

About 2-[ethyl(propyl)amino]-1-phenylethanone

2-[ethyl(propyl)amino]-1-phenylethanone (PubChem CID 43795306) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-[ethyl(propyl)amino]-1-phenylethanone.

Molecular Properties

Compound Name2-[ethyl(propyl)amino]-1-phenylethanone
PubChem CID43795306
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2-[ethyl(propyl)amino]-1-phenylethanone
SMILESCCCN(CC)CC(=O)c1ccccc1
InChIInChI=1S/C13H19NO/c1-3-10-14(4-2)11-13(15)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
InChIKeyRXQRXAXZMVBXHZ-UHFFFAOYSA-N
XLogP2.60
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[ethyl(propyl)amino]-1-phenylpropan-1-one
CID 62614249
2-(dipropylamino)-1-(4-phenylphenyl)ethanone
CID 82051052
4-[ethyl(propyl)amino]-1-phenylbutan-1-one
CID 43792935
3-(diethylamino)-1-phenylpropan-1-one;hydrochloride
CID 13496280
ethyl(phenacyl)carbamic acid
CID 70573901
2-[bis(2-methoxyethyl)amino]-1-phenylethanone
CID 60649797
1-(4-aminophenyl)-2-[butyl(ethyl)amino]ethanone
CID 82256582
2-[ethyl(furan-2-ylmethyl)amino]-1-phenylethanone
CID 62037006
1-(3-aminophenyl)-2-[butyl(ethyl)amino]ethanone
CID 82071639
3-carboxyphenolate;N,N-diethylpropan-1-amine
CID 54677139
N-benzyl-2-[ethyl(propyl)amino]acetamide
CID 142231835
ethane;2-[ethyl(propyl)amino]acetic acid
CID 143677754

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(propyl)amino]-1-phenylethanone?
The IUPAC name of 2-[ethyl(propyl)amino]-1-phenylethanone (CID 43795306) is 2-[ethyl(propyl)amino]-1-phenylethanone.
What is the SMILES notation for 2-[ethyl(propyl)amino]-1-phenylethanone?
The canonical SMILES for 2-[ethyl(propyl)amino]-1-phenylethanone is CCCN(CC)CC(=O)c1ccccc1.
What is the InChIKey of 2-[ethyl(propyl)amino]-1-phenylethanone?
The InChIKey is RXQRXAXZMVBXHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-3-10-14(4-2)11-13(15)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3.
What are the key properties of 2-[ethyl(propyl)amino]-1-phenylethanone?
2-[ethyl(propyl)amino]-1-phenylethanone has a molecular weight of 205.30 g/mol, XLogP of 2.60, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(propyl)amino]-1-phenylethanone is sourced from PubChem (CID 43795306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).