N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride

C15H22ClN3O3 — CID 119680223

IUPACN-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)CNCC1CC1.Cl
InChIInChI=1S/C15H21N3O3.ClH/c1-10(19)17-12-5-6-14(21-2)13(7-12)18-15(20)9-16-8-11-3-4-11;/h5-7,11,16H,3-4,8-9H2,1-2H3,(H,17,19)(H,18,20);1H
InChIKeyCNYGPYYFILGNTQ-UHFFFAOYSA-N
MW327.81 g/mol
LogP2.01
Rot. Bonds7

About N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride

N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride (PubChem CID 119680223) has the molecular formula C15H22ClN3O3 and a molecular weight of 327.81 g/mol. Its IUPAC name is N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride
PubChem CID119680223
Molecular FormulaC15H22ClN3O3
Molecular Weight327.81 g/mol
Exact Mass327.13
IUPAC NameN-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)CNCC1CC1.Cl
InChIInChI=1S/C15H21N3O3.ClH/c1-10(19)17-12-5-6-14(21-2)13(7-12)18-15(20)9-16-8-11-3-4-11;/h5-7,11,16H,3-4,8-9H2,1-2H3,(H,17,19)(H,18,20);1H
InChIKeyCNYGPYYFILGNTQ-UHFFFAOYSA-N
XLogP2.01
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.81
LogP ≤ 52.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide
CID 60842124
2-(cyclopropylmethylamino)-N-(3-fluoro-4-methoxyphenyl)acetamide;hydrochloride
CID 119705687
3-[[2-(cyclopropylmethylamino)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide;hydrochloride
CID 119741837
N-[3-(2-amino-2-oxoethoxy)-4-methoxyphenyl]-2-(cyclopropylmethylamino)acetamide;hydrochloride
CID 119717528
2-(cyclopropylmethylamino)-N-(3,4-dimethylphenyl)acetamide;hydrochloride
CID 119670640
N-[4-[[2-(cyclopropylmethylamino)acetyl]amino]-2,5-dimethoxyphenyl]benzamide;hydrochloride
CID 119679319
2-(5-acetamido-2-fluoroanilino)-N-(5-acetamido-2-methoxyphenyl)acetamide
CID 37279177
2-(cyclopropylmethylamino)-N-[4-(ethylsulfonylamino)-3-methoxyphenyl]acetamide
CID 119739337
N-(5-acetamido-2-methoxyphenyl)-2-(4-methylphenyl)acetamide
CID 17432370
N-(5-acetamido-2-methoxyphenyl)-2-(azocan-1-yl)acetamide
CID 8680244
N-(5-acetamido-2-methoxyphenyl)-3-chloropropanamide
CID 43236542
2-[(4-hydroxycyclohexyl)methylamino]-N-(2-methoxyphenyl)acetamide
CID 106133704

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride?
The IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride (CID 119680223) is N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride.
What is the SMILES notation for N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride?
The canonical SMILES for N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride is COc1ccc(NC(C)=O)cc1NC(=O)CNCC1CC1.Cl.
What is the InChIKey of N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride?
The InChIKey is CNYGPYYFILGNTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3.ClH/c1-10(19)17-12-5-6-14(21-2)13(7-12)18-15(20)9-16-8-11-3-4-11;/h5-7,11,16H,3-4,8-9H2,1-2H3,(H,17,19)(H,18,20);1H.
What are the key properties of N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride?
N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride has a molecular weight of 327.81 g/mol, XLogP of 2.01, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride is sourced from PubChem (CID 119680223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).