2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride

C19H24ClFN2O2 — CID 119283180

IUPAC2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride
SMILESCCCC(N)C(=O)NCc1ccc(OCc2cccc(F)c2)cc1.Cl
InChIInChI=1S/C19H23FN2O2.ClH/c1-2-4-18(21)19(23)22-12-14-7-9-17(10-8-14)24-13-15-5-3-6-16(20)11-15;/h3,5-11,18H,2,4,12-13,21H2,1H3,(H,22,23);1H
InChIKeyHRDUKNHXDUBNSW-UHFFFAOYSA-N
MW366.86 g/mol
LogP3.57
Rot. Bonds8

About 2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride

2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride (PubChem CID 119283180) has the molecular formula C19H24ClFN2O2 and a molecular weight of 366.86 g/mol. Its IUPAC name is 2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride
PubChem CID119283180
Molecular FormulaC19H24ClFN2O2
Molecular Weight366.86 g/mol
Exact Mass366.15
IUPAC Name2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride
SMILESCCCC(N)C(=O)NCc1ccc(OCc2cccc(F)c2)cc1.Cl
InChIInChI=1S/C19H23FN2O2.ClH/c1-2-4-18(21)19(23)22-12-14-7-9-17(10-8-14)24-13-15-5-3-6-16(20)11-15;/h3,5-11,18H,2,4,12-13,21H2,1H3,(H,22,23);1H
InChIKeyHRDUKNHXDUBNSW-UHFFFAOYSA-N
XLogP3.57
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.86
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide
CID 153327338
2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]-3-methoxypropanamide;hydrochloride
CID 120985182
N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]-2,2-dimethylpropanamide
CID 37469359
(2S)-2-amino-4-methyl-N-[(4-phenylmethoxyphenyl)methyl]pentanamide;hydrochloride
CID 119712185
2-amino-N-[(3-ethoxyphenyl)methyl]pentanamide
CID 60872985
2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride
CID 119284258
2-amino-N-benzylpentanamide
CID 11020044
2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide
CID 46222705
N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]-2-nitroso-2-pyridin-2-ylacetamide
CID 123999268
4-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]butanamide
CID 119283185
2-amino-N-[[3-(2,2-difluoroethoxy)phenyl]methyl]pentanamide
CID 119315367
(2S)-2-[[4-[(3-fluorophenyl)methoxy]phenyl]methylamino]-N-methylpropanamide
CID 10193260

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride?
The IUPAC name of 2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride (CID 119283180) is 2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride is CCCC(N)C(=O)NCc1ccc(OCc2cccc(F)c2)cc1.Cl.
What is the InChIKey of 2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride?
The InChIKey is HRDUKNHXDUBNSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O2.ClH/c1-2-4-18(21)19(23)22-12-14-7-9-17(10-8-14)24-13-15-5-3-6-16(20)11-15;/h3,5-11,18H,2,4,12-13,21H2,1H3,(H,22,23);1H.
What are the key properties of 2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride?
2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride has a molecular weight of 366.86 g/mol, XLogP of 3.57, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride is sourced from PubChem (CID 119283180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).