N-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide

C13H17ClN2O2 — CID 60842124

IUPACN-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide
SMILESCOc1ccc(Cl)cc1NC(=O)CNCC1CC1
InChIInChI=1S/C13H17ClN2O2/c1-18-12-5-4-10(14)6-11(12)16-13(17)8-15-7-9-2-3-9/h4-6,9,15H,2-3,7-8H2,1H3,(H,16,17)
InChIKeyXVZGSCWIQYQNIS-UHFFFAOYSA-N
MW268.74 g/mol
LogP2.29
Rot. Bonds6

About N-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide

N-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide (PubChem CID 60842124) has the molecular formula C13H17ClN2O2 and a molecular weight of 268.74 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide
PubChem CID60842124
Molecular FormulaC13H17ClN2O2
Molecular Weight268.74 g/mol
Exact Mass268.10
IUPAC NameN-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide
SMILESCOc1ccc(Cl)cc1NC(=O)CNCC1CC1
InChIInChI=1S/C13H17ClN2O2/c1-18-12-5-4-10(14)6-11(12)16-13(17)8-15-7-9-2-3-9/h4-6,9,15H,2-3,7-8H2,1H3,(H,16,17)
InChIKeyXVZGSCWIQYQNIS-UHFFFAOYSA-N
XLogP2.29
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.74
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-3-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide
CID 119815029
N-(5-chloro-2-ethoxyphenyl)-2-(cyclopropylmethylamino)acetamide
CID 54862706
N-(5-chloro-2-methoxyphenyl)-2-[(4-chlorophenyl)methylamino]acetamide
CID 108998151
N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride
CID 119680223
N-(5-chloro-2-methoxyphenyl)-2-(2-methoxyethylamino)acetamide
CID 78908383
3-[[2-(cyclopropylmethylamino)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide;hydrochloride
CID 119741837
2-chloro-N-(5-chloro-2-methoxyphenyl)acetamide
CID 776663
N-(4-chloro-2,5-dimethoxyphenyl)-2-(5-chloro-2-methoxyanilino)acetamide
CID 42026368
N-(5-chloro-2-methoxyphenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide
CID 9068771
N-(4-chloro-2-methoxy-5-methylphenyl)-N'-(5-chloro-2-methoxyphenyl)propanediamide
CID 108955473
2-(5-chloro-2-methoxyanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
CID 26417292
N-(5-chloro-2-methoxyphenyl)-2-(4,5-dimethoxy-2-methylanilino)acetamide
CID 9105369

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide (CID 60842124) is N-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide is COc1ccc(Cl)cc1NC(=O)CNCC1CC1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide?
The InChIKey is XVZGSCWIQYQNIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClN2O2/c1-18-12-5-4-10(14)6-11(12)16-13(17)8-15-7-9-2-3-9/h4-6,9,15H,2-3,7-8H2,1H3,(H,16,17).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide?
N-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide has a molecular weight of 268.74 g/mol, XLogP of 2.29, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide is sourced from PubChem (CID 60842124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).