3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide

C13H26N2O3 — CID 66009602

IUPAC3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide
SMILESCOCCCN(CCOC)C(=O)C1CCC(N)C1
InChIInChI=1S/C13H26N2O3/c1-17-8-3-6-15(7-9-18-2)13(16)11-4-5-12(14)10-11/h11-12H,3-10,14H2,1-2H3
InChIKeyBTIHPGBRBZYTMV-UHFFFAOYSA-N
MW258.36 g/mol
LogP0.63
Rot. Bonds8

About 3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide

3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide (PubChem CID 66009602) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is 3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide
PubChem CID66009602
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC Name3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide
SMILESCOCCCN(CCOC)C(=O)C1CCC(N)C1
InChIInChI=1S/C13H26N2O3/c1-17-8-3-6-15(7-9-18-2)13(16)11-4-5-12(14)10-11/h11-12H,3-10,14H2,1-2H3
InChIKeyBTIHPGBRBZYTMV-UHFFFAOYSA-N
XLogP0.63
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-amino-N-[3-(dimethylamino)propyl]-N-(2-methoxyethyl)cyclopentane-1-carboxamide
CID 66008773
3-[2-methoxyethyl(3-methoxypropyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103550455
3-amino-N-benzyl-N-(4-methoxybutyl)cyclopentane-1-carboxamide
CID 119752506
cis-(1R,3S)-3-amino-N-[(4-ethylphenyl)methyl]-N-(2-methoxyethyl)cyclopentane-1-carboxamide
CID 133109702
cis-(1S,3R)-3-amino-N-[2-(4-chlorophenyl)sulfanylethyl]-N-(2-methoxyethyl)cyclopentane-1-carboxamide
CID 56905135
3-amino-N-butan-2-yl-N-(2-methoxyethyl)cyclopentane-1-carboxamide
CID 66010253
N-(3-aminopropyl)-N-(2-methoxyethyl)cycloheptanecarboxamide
CID 63287770
3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide
CID 62782108
3-amino-N,N-bis(2-ethoxyethyl)cyclohexane-1-carboxamide
CID 82959930
3-[cyclopropanecarbonyl(2-methoxyethyl)amino]propanoic acid
CID 82323958
4-amino-N,N-bis(2-ethoxyethyl)cyclohexane-1-carboxamide
CID 82960257
(2S,4S)-N,N-bis(2-methoxyethyl)-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120616330

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide (CID 66009602) is 3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide is COCCCN(CCOC)C(=O)C1CCC(N)C1.
What is the InChIKey of 3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide?
The InChIKey is BTIHPGBRBZYTMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-17-8-3-6-15(7-9-18-2)13(16)11-4-5-12(14)10-11/h11-12H,3-10,14H2,1-2H3.
What are the key properties of 3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide?
3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide has a molecular weight of 258.36 g/mol, XLogP of 0.63, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 66009602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).