2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide

C16H24N2O2 — CID 64824766

IUPAC2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide
SMILESCN(CCCOc1ccccc1)C(=O)C1CCCC1N
InChIInChI=1S/C16H24N2O2/c1-18(16(19)14-9-5-10-15(14)17)11-6-12-20-13-7-3-2-4-8-13/h2-4,7-8,14-15H,5-6,9-12,17H2,1H3
InChIKeyDWLOQQCCJMOFEX-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.04
Rot. Bonds6

About 2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide

2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide (PubChem CID 64824766) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide
PubChem CID64824766
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide
SMILESCN(CCCOc1ccccc1)C(=O)C1CCCC1N
InChIInChI=1S/C16H24N2O2/c1-18(16(19)14-9-5-10-15(14)17)11-6-12-20-13-7-3-2-4-8-13/h2-4,7-8,14-15H,5-6,9-12,17H2,1H3
InChIKeyDWLOQQCCJMOFEX-UHFFFAOYSA-N
XLogP2.04
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.04
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

trans-(1S,2S)-2-amino-N-[3-(4-fluorophenoxy)propyl]-N-methylcyclopentane-1-carboxamide
CID 99849846
2-amino-N-[2-(4-bromophenoxy)ethyl]-N-methylcyclopentane-1-carboxamide
CID 64823580
3-amino-N-methyl-N-(3-phenoxypropyl)cyclohexane-1-carboxamide;hydrochloride
CID 119731934
4-[methyl(3-phenoxypropyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 120672844
trans-(1R,3R)-3-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide
CID 97123271
cis-(1S,3R)-3-hydroxy-N-methyl-N-(3-phenoxypropyl)cyclohexane-1-carboxamide
CID 91777791
4-[(2-aminocyclopentanecarbonyl)-methylamino]butanoic acid
CID 64823823
2-phenoxyethyl 2-aminocyclohexane-1-carboxylate
CID 64818428
N-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide
CID 66264833
N-methyl-N-(3-phenoxypropyl)acetamide
CID 60757278
(4S)-N,1-dimethyl-2-oxo-N-(3-phenoxypropyl)piperidine-4-carboxamide
CID 94168581
3-amino-N-(3-methoxypropyl)-N,2-dimethylcyclohexane-1-carboxamide
CID 63009884

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide (CID 64824766) is 2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide is CN(CCCOc1ccccc1)C(=O)C1CCCC1N.
What is the InChIKey of 2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide?
The InChIKey is DWLOQQCCJMOFEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-18(16(19)14-9-5-10-15(14)17)11-6-12-20-13-7-3-2-4-8-13/h2-4,7-8,14-15H,5-6,9-12,17H2,1H3.
What are the key properties of 2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide?
2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 64824766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).