3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide

C15H21ClN2O2 — CID 119725465

IUPAC3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide
SMILESCC(CNC(=O)C1CCC(N)C1)Oc1ccccc1Cl
InChIInChI=1S/C15H21ClN2O2/c1-10(20-14-5-3-2-4-13(14)16)9-18-15(19)11-6-7-12(17)8-11/h2-5,10-12H,6-9,17H2,1H3,(H,18,19)
InChIKeyMTBUZLBLHFAQTO-UHFFFAOYSA-N
MW296.80 g/mol
LogP2.35
Rot. Bonds5

About 3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide

3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide (PubChem CID 119725465) has the molecular formula C15H21ClN2O2 and a molecular weight of 296.80 g/mol. Its IUPAC name is 3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide
PubChem CID119725465
Molecular FormulaC15H21ClN2O2
Molecular Weight296.80 g/mol
Exact Mass296.13
IUPAC Name3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide
SMILESCC(CNC(=O)C1CCC(N)C1)Oc1ccccc1Cl
InChIInChI=1S/C15H21ClN2O2/c1-10(20-14-5-3-2-4-13(14)16)9-18-15(19)11-6-7-12(17)8-11/h2-5,10-12H,6-9,17H2,1H3,(H,18,19)
InChIKeyMTBUZLBLHFAQTO-UHFFFAOYSA-N
XLogP2.35
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.80
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[2-(2-bromophenoxy)propyl]cyclopentane-1-carboxamide;hydrochloride
CID 119804683
(2R,4R)-N-[(2R)-2-(2-chlorophenoxy)propyl]-4-hydroxypyrrolidine-2-carboxamide
CID 125134999
3-amino-N-[2-(3-fluorophenoxy)propyl]cyclopentane-1-carboxamide;hydrochloride
CID 119804739
3-amino-N-[2-(2-chlorophenyl)-2-hydroxyethyl]cyclopentane-1-carboxamide
CID 154759854
3-amino-N-(2-methoxypropyl)cyclopentane-1-carboxamide
CID 102695070
trans-(1R,3R)-3-amino-N-[(2S)-2-hydroxy-2-(2-methoxyphenyl)ethyl]cyclopentane-1-carboxamide
CID 124778177
3-amino-N-[2-(2-methylphenoxy)butyl]cyclopentane-1-carboxamide;hydrochloride
CID 119819930
3-[2-(2-chlorophenoxy)propyl]-1-cyclopropyl-1-(2-hydroxyethyl)urea
CID 111508528
3-amino-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119673508
3-amino-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119830666
3-amino-N-[2-(4-chlorophenyl)-2-methoxyethyl]cyclopentane-1-carboxamide
CID 119803119
9-amino-N-[2-(2-fluorophenoxy)propyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120991075

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide (CID 119725465) is 3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide is CC(CNC(=O)C1CCC(N)C1)Oc1ccccc1Cl.
What is the InChIKey of 3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide?
The InChIKey is MTBUZLBLHFAQTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O2/c1-10(20-14-5-3-2-4-13(14)16)9-18-15(19)11-6-7-12(17)8-11/h2-5,10-12H,6-9,17H2,1H3,(H,18,19).
What are the key properties of 3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide?
3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide has a molecular weight of 296.80 g/mol, XLogP of 2.35, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(2-chlorophenoxy)propyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119725465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).