4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride

C13H27ClN2O2 — CID 119339921

IUPAC4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride
SMILESCOCCC1(CNC(=O)CCCN)CCCC1.Cl
InChIInChI=1S/C13H26N2O2.ClH/c1-17-10-8-13(6-2-3-7-13)11-15-12(16)5-4-9-14;/h2-11,14H2,1H3,(H,15,16);1H
InChIKeySEFDAKMUJPLOCQ-UHFFFAOYSA-N
MW278.82 g/mol
LogP1.86
Rot. Bonds8

About 4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride

4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride (PubChem CID 119339921) has the molecular formula C13H27ClN2O2 and a molecular weight of 278.82 g/mol. Its IUPAC name is 4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride.

Molecular Properties

Compound Name4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride
PubChem CID119339921
Molecular FormulaC13H27ClN2O2
Molecular Weight278.82 g/mol
Exact Mass278.18
IUPAC Name4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride
SMILESCOCCC1(CNC(=O)CCCN)CCCC1.Cl
InChIInChI=1S/C13H26N2O2.ClH/c1-17-10-8-13(6-2-3-7-13)11-15-12(16)5-4-9-14;/h2-11,14H2,1H3,(H,15,16);1H
InChIKeySEFDAKMUJPLOCQ-UHFFFAOYSA-N
XLogP1.86
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.82
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide
CID 114112929
3-amino-N-[[1-(2-methoxyethyl)cyclobutyl]methyl]butanamide
CID 119820393
2-(2-methoxyethylamino)-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]acetamide
CID 119812143
3-(2-aminophenyl)-N-[[1-(2-methoxyethyl)cyclobutyl]methyl]propanamide;hydrochloride
CID 120611838
N-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide
CID 114754126
N-[[1-(2-aminoethyl)cyclopropyl]methyl]-4-ethoxybutanamide
CID 114758885
2-amino-N-[[1-(2-methoxyethyl)cyclobutyl]methyl]propanamide;hydrochloride
CID 119344536
2-amino-N-[[1-(2-methoxyethyl)cyclobutyl]methyl]-2-methylpropanamide
CID 119344523
6-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]hexanamide
CID 114756702
(2S)-2-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-methylpentanamide;hydrochloride
CID 119812150
3-[[1-(2-methoxyethyl)cyclohexyl]methylcarbamoylamino]propanoic acid
CID 122010715
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[[1-(2-methoxyethyl)cyclobutyl]methyl]acetamide;hydrochloride
CID 119820378

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride?
The IUPAC name of 4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride (CID 119339921) is 4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride.
What is the SMILES notation for 4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride?
The canonical SMILES for 4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride is COCCC1(CNC(=O)CCCN)CCCC1.Cl.
What is the InChIKey of 4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride?
The InChIKey is SEFDAKMUJPLOCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2.ClH/c1-17-10-8-13(6-2-3-7-13)11-15-12(16)5-4-9-14;/h2-11,14H2,1H3,(H,15,16);1H.
What are the key properties of 4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride?
4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride has a molecular weight of 278.82 g/mol, XLogP of 1.86, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride is sourced from PubChem (CID 119339921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).