2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride

C14H21ClN2O2 — CID 119676983

IUPAC2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride
SMILESCl.O=C(CNCC1CC1)NCC(O)c1ccccc1
InChIInChI=1S/C14H20N2O2.ClH/c17-13(12-4-2-1-3-5-12)9-16-14(18)10-15-8-11-6-7-11;/h1-5,11,13,15,17H,6-10H2,(H,16,18);1H
InChIKeyBHCWMWSEHSCRGF-UHFFFAOYSA-N
MW284.79 g/mol
LogP1.26
Rot. Bonds7

About 2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride

2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride (PubChem CID 119676983) has the molecular formula C14H21ClN2O2 and a molecular weight of 284.79 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride
PubChem CID119676983
Molecular FormulaC14H21ClN2O2
Molecular Weight284.79 g/mol
Exact Mass284.13
IUPAC Name2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride
SMILESCl.O=C(CNCC1CC1)NCC(O)c1ccccc1
InChIInChI=1S/C14H20N2O2.ClH/c17-13(12-4-2-1-3-5-12)9-16-14(18)10-15-8-11-6-7-11;/h1-5,11,13,15,17H,6-10H2,(H,16,18);1H
InChIKeyBHCWMWSEHSCRGF-UHFFFAOYSA-N
XLogP1.26
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.79
LogP ≤ 51.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylmethylamino)-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]acetamide;hydrochloride
CID 119730492
2-(cyclopropylmethylamino)-N-[2-hydroxy-2-(3-propan-2-yloxyphenyl)ethyl]acetamide
CID 119792549
N-(2-hydroxy-2-phenylethyl)-2-piperidin-4-ylacetamide
CID 54910069
2-(cyclopropylmethylamino)-N-(3-phenylbutyl)acetamide
CID 55152746
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-hydroxy-2-phenylethyl)acetamide
CID 79609823
N-[2-[(2-hydroxy-2-phenylethyl)amino]-2-oxoethyl]-2,2-dimethylpropanamide
CID 43416331
3-[[2-(cyclopropylmethylamino)acetyl]amino]-3-phenylpropanoic acid
CID 61157097
3-cyclohexyl-N-(2-hydroxy-2-phenylethyl)propanamide
CID 43391299
2-(cyclopropylmethylamino)-N-(1,1-diphenylpropan-2-yl)acetamide
CID 119716624
N-[(4-bromophenyl)-phenylmethyl]-2-(cyclopropylmethylamino)acetamide;hydrochloride
CID 119750778
N-[2-(benzylsulfamoyl)ethyl]-2-(cyclopropylmethylamino)acetamide;hydrochloride
CID 119723679
N-benzyl-2-(cyclobutylmethylamino)acetamide
CID 43298629

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride?
The IUPAC name of 2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride (CID 119676983) is 2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride is Cl.O=C(CNCC1CC1)NCC(O)c1ccccc1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride?
The InChIKey is BHCWMWSEHSCRGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2.ClH/c17-13(12-4-2-1-3-5-12)9-16-14(18)10-15-8-11-6-7-11;/h1-5,11,13,15,17H,6-10H2,(H,16,18);1H.
What are the key properties of 2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride?
2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride has a molecular weight of 284.79 g/mol, XLogP of 1.26, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride is sourced from PubChem (CID 119676983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).