2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide

C11H22N2O2 — CID 64825022

IUPAC2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide
SMILESCOCCCN(C)C(=O)C1CCCC1N
InChIInChI=1S/C11H22N2O2/c1-13(7-4-8-15-2)11(14)9-5-3-6-10(9)12/h9-10H,3-8,12H2,1-2H3
InChIKeyLXYDUUNOCUROAW-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.61
Rot. Bonds5

About 2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide

2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide (PubChem CID 64825022) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide
PubChem CID64825022
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide
SMILESCOCCCN(C)C(=O)C1CCCC1N
InChIInChI=1S/C11H22N2O2/c1-13(7-4-8-15-2)11(14)9-5-3-6-10(9)12/h9-10H,3-8,12H2,1-2H3
InChIKeyLXYDUUNOCUROAW-UHFFFAOYSA-N
XLogP0.61
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(1S,11R)-2,9-diazabicyclo[9.3.0]tetradecan-10-one
CID 110199279
(1S,11R)-9-methyl-2-(2-methylpropanoyl)-2,9-diazabicyclo[9.3.0]tetradecan-10-one
CID 110199390
(1S,11R)-9-methyl-2-propanoyl-2,9-diazabicyclo[9.3.0]tetradecan-10-one
CID 110199397
(8aR,11aS)-1-propanoyl-3,4,5,6,7,8a,9,10,11,11a-decahydro-2H-cyclopenta[b][1,5]diazecin-8-one
CID 110201562
(9aR,12aS)-1-isopentyldodecahydrocyclopenta[b][1,5]diazacycloundecin-9(2H)-one
CID 110199292
Methyl 3-[3-(cyclopentylformamido)butanamido]butanoate
CID 56823981
(1S,11R)-2-(cyclobutanecarbonyl)-2,9-diazabicyclo[9.3.0]tetradecan-10-one
CID 110199253
(1S,11R)-2-propanoyl-2,9-diazabicyclo[9.3.0]tetradecan-10-one
CID 110199282
(1S,11R)-2-acetyl-2,9-diazabicyclo[9.3.0]tetradecan-10-one
CID 110199285
N-Ethyl-9-oxo-tetradecahydrocyclopenta[B]1,5-diazacycloundecane-1-carboxamide
CID 110199323
(1S,11R)-2-(3-methoxypropanoyl)-9-methyl-2,9-diazabicyclo[9.3.0]tetradecan-10-one
CID 110199373
N-(3-Methoxypropyl)-8-methyl-9-oxo-tetradecahydrocyclopenta[B]1,5-diazacycloundecane-1-carboxamide
CID 110199422

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide (CID 64825022) is 2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide is COCCCN(C)C(=O)C1CCCC1N.
What is the InChIKey of 2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide?
The InChIKey is LXYDUUNOCUROAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-13(7-4-8-15-2)11(14)9-5-3-6-10(9)12/h9-10H,3-8,12H2,1-2H3.
What are the key properties of 2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide?
2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 0.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-methoxypropyl)-N-methylcyclopentane-1-carboxamide is sourced from PubChem (CID 64825022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).