N-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide

C14H20ClN3O2 — CID 62015649

IUPACN-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide
SMILESO=C(CN(CCO)C1CCCC1)Nc1cccnc1Cl
InChIInChI=1S/C14H20ClN3O2/c15-14-12(6-3-7-16-14)17-13(20)10-18(8-9-19)11-4-1-2-5-11/h3,6-7,11,19H,1-2,4-5,8-10H2,(H,17,20)
InChIKeyYYISEXILFDIFCF-UHFFFAOYSA-N
MW297.79 g/mol
LogP1.91
Rot. Bonds6

About N-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide

N-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide (PubChem CID 62015649) has the molecular formula C14H20ClN3O2 and a molecular weight of 297.79 g/mol. Its IUPAC name is N-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide
PubChem CID62015649
Molecular FormulaC14H20ClN3O2
Molecular Weight297.79 g/mol
Exact Mass297.12
IUPAC NameN-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide
SMILESO=C(CN(CCO)C1CCCC1)Nc1cccnc1Cl
InChIInChI=1S/C14H20ClN3O2/c15-14-12(6-3-7-16-14)17-13(20)10-18(8-9-19)11-4-1-2-5-11/h3,6-7,11,19H,1-2,4-5,8-10H2,(H,17,20)
InChIKeyYYISEXILFDIFCF-UHFFFAOYSA-N
XLogP1.91
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.79
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(2-chloro-3-pyridinyl)-2-[ethyl(piperidin-4-yl)amino]acetamide
CID 60807840
2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2,3-dimethylphenyl)acetamide
CID 60911691
N-(2-chloro-3-pyridinyl)-2-[(2-hydroxycyclohexyl)-methylamino]acetamide
CID 102636426
N-(2-chloro-3-pyridinyl)-2-[2-hydroxyethyl(propan-2-yl)amino]acetamide
CID 60691996
N-(2-chloro-3-pyridinyl)-2-[ethyl(pyrrolidin-3-yl)amino]acetamide
CID 63300131
2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2,4-dichlorophenyl)acetamide
CID 78897433
N-(2-chlorophenyl)-2-[cyclopentyl(2-phenylethyl)amino]acetamide
CID 51128255
N-(4-bromophenyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide
CID 60911559
2-[cyclobutyl(2-hydroxyethyl)amino]-N-(2,5-difluorophenyl)acetamide
CID 102676904
N-(5-bromo-2-pyridinyl)-2-[cyclobutyl(2-hydroxyethyl)amino]acetamide
CID 102676743
N-(2-chloro-3-pyridinyl)-2-piperidin-1-ium-1-ylacetamide
CID 7784525
N-[(4-chlorophenyl)methyl]-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide
CID 60912428

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide?
The IUPAC name of N-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide (CID 62015649) is N-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide.
What is the SMILES notation for N-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide?
The canonical SMILES for N-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide is O=C(CN(CCO)C1CCCC1)Nc1cccnc1Cl.
What is the InChIKey of N-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide?
The InChIKey is YYISEXILFDIFCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN3O2/c15-14-12(6-3-7-16-14)17-13(20)10-18(8-9-19)11-4-1-2-5-11/h3,6-7,11,19H,1-2,4-5,8-10H2,(H,17,20).
What are the key properties of N-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide?
N-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide has a molecular weight of 297.79 g/mol, XLogP of 1.91, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-3-pyridinyl)-2-[cyclopentyl(2-hydroxyethyl)amino]acetamide is sourced from PubChem (CID 62015649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).