N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride

C14H23ClN2O — CID 119438958

IUPACN-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride
SMILESCCCCC(=O)Nc1ccccc1CNCC.Cl
InChIInChI=1S/C14H22N2O.ClH/c1-3-5-10-14(17)16-13-9-7-6-8-12(13)11-15-4-2;/h6-9,15H,3-5,10-11H2,1-2H3,(H,16,17);1H
InChIKeyQCPWRKKJQGUKFI-UHFFFAOYSA-N
MW270.80 g/mol
LogP3.35
Rot. Bonds7

About N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride

N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride (PubChem CID 119438958) has the molecular formula C14H23ClN2O and a molecular weight of 270.80 g/mol. Its IUPAC name is N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride
PubChem CID119438958
Molecular FormulaC14H23ClN2O
Molecular Weight270.80 g/mol
Exact Mass270.15
IUPAC NameN-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride
SMILESCCCCC(=O)Nc1ccccc1CNCC.Cl
InChIInChI=1S/C14H22N2O.ClH/c1-3-5-10-14(17)16-13-9-7-6-8-12(13)11-15-4-2;/h6-9,15H,3-5,10-11H2,1-2H3,(H,16,17);1H
InChIKeyQCPWRKKJQGUKFI-UHFFFAOYSA-N
XLogP3.35
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.80
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(ethylaminomethyl)phenyl]nonanamide
CID 65425982
N'-[2-(ethylaminomethyl)phenyl]-N-propylpentanediamide;hydrochloride
CID 119440586
N-[2-(ethylaminomethyl)phenyl]-5,5-dimethylhexanamide
CID 119440882
N-[2-(ethylaminomethyl)phenyl]pent-4-enamide
CID 62678727
N-[2-(methanesulfinamidomethyl)phenyl]pentanamide
CID 167063111
N-(2-ethylphenyl)undecanamide
CID 5078439
N-(2-ethylphenyl)heptanamide
CID 4582103
N-[2-(ethylaminomethyl)phenyl]-4-oxo-4-phenylbutanamide
CID 119440695
N-[2-(ethylaminomethyl)phenyl]pent-4-ynamide
CID 114028604
N-[2-(ethylaminomethyl)phenyl]-2-methylsulfonylacetamide;hydrochloride
CID 119440105
N-[2-(ethylaminomethyl)phenyl]-3-pyrazol-1-ylpropanamide;dihydrochloride
CID 119439339
3-(2,4-dimethylphenyl)-N-[2-(ethylaminomethyl)phenyl]propanamide;hydrochloride
CID 119439013

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride?
The IUPAC name of N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride (CID 119438958) is N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride.
What is the SMILES notation for N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride?
The canonical SMILES for N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride is CCCCC(=O)Nc1ccccc1CNCC.Cl.
What is the InChIKey of N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride?
The InChIKey is QCPWRKKJQGUKFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O.ClH/c1-3-5-10-14(17)16-13-9-7-6-8-12(13)11-15-4-2;/h6-9,15H,3-5,10-11H2,1-2H3,(H,16,17);1H.
What are the key properties of N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride?
N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride has a molecular weight of 270.80 g/mol, XLogP of 3.35, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride is sourced from PubChem (CID 119438958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).