2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide

C14H19ClN2O — CID 63821646

IUPAC2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide
SMILESCC1(CNC(=O)c2cc(Cl)ccc2N)CCCC1
InChIInChI=1S/C14H19ClN2O/c1-14(6-2-3-7-14)9-17-13(18)11-8-10(15)4-5-12(11)16/h4-5,8H,2-3,6-7,9,16H2,1H3,(H,17,18)
InChIKeyFOFWRUNDDAWVMW-UHFFFAOYSA-N
MW266.77 g/mol
LogP3.23
Rot. Bonds3

About 2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide

2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide (PubChem CID 63821646) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is 2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide.

Molecular Properties

Compound Name2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide
PubChem CID63821646
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC Name2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide
SMILESCC1(CNC(=O)c2cc(Cl)ccc2N)CCCC1
InChIInChI=1S/C14H19ClN2O/c1-14(6-2-3-7-14)9-17-13(18)11-8-10(15)4-5-12(11)16/h4-5,8H,2-3,6-7,9,16H2,1H3,(H,17,18)
InChIKeyFOFWRUNDDAWVMW-UHFFFAOYSA-N
XLogP3.23
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide
CID 86901481
5-chloro-N-[(1-methylcyclohexyl)methyl]-2-nitrobenzamide
CID 103753259
2-amino-4,5-difluoro-N-[(1-methylcyclobutyl)methyl]benzamide
CID 114107072
4-amino-2-chloro-N-[(1-methylcyclopentyl)methyl]benzamide;hydrochloride
CID 119780555
2-amino-N-[(1-methylcyclobutyl)methyl]benzamide;hydrochloride
CID 119945728
2-chloro-N-[(1-methylcyclopentyl)methyl]-5-nitrobenzamide
CID 63821949
2,5-dibromo-N-[(1-methylcyclopentyl)methyl]benzamide
CID 114372364
2-amino-N-(2-amino-2-oxoethyl)-5-chlorobenzamide
CID 16778185
3-amino-N-[(1-methylcyclopentyl)methyl]-2-nitrobenzamide
CID 115549077
2-chloro-N-[(1-methylcyclohexyl)methyl]-4-nitrobenzamide
CID 103753304
2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide
CID 65103861
2-amino-N-[(1-hydroxycyclopentyl)methyl]-5-methylbenzamide
CID 65106081

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide?
The IUPAC name of 2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide (CID 63821646) is 2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide.
What is the SMILES notation for 2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide?
The canonical SMILES for 2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide is CC1(CNC(=O)c2cc(Cl)ccc2N)CCCC1.
What is the InChIKey of 2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide?
The InChIKey is FOFWRUNDDAWVMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c1-14(6-2-3-7-14)9-17-13(18)11-8-10(15)4-5-12(11)16/h4-5,8H,2-3,6-7,9,16H2,1H3,(H,17,18).
What are the key properties of 2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide?
2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide has a molecular weight of 266.77 g/mol, XLogP of 3.23, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide is sourced from PubChem (CID 63821646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).