2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride

C17H29Cl2N3O — CID 119885013

IUPAC2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride
SMILESCCN1CCC(CCNC(=O)C(N)c2ccccc2)CC1.Cl.Cl
InChIInChI=1S/C17H27N3O.2ClH/c1-2-20-12-9-14(10-13-20)8-11-19-17(21)16(18)15-6-4-3-5-7-15;;/h3-7,14,16H,2,8-13,18H2,1H3,(H,19,21);2*1H
InChIKeyBNWSJONQQFLGLB-UHFFFAOYSA-N
MW362.35 g/mol
LogP2.77
Rot. Bonds6

About 2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride

2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride (PubChem CID 119885013) has the molecular formula C17H29Cl2N3O and a molecular weight of 362.35 g/mol. Its IUPAC name is 2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride.

Molecular Properties

Compound Name2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride
PubChem CID119885013
Molecular FormulaC17H29Cl2N3O
Molecular Weight362.35 g/mol
Exact Mass361.17
IUPAC Name2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride
SMILESCCN1CCC(CCNC(=O)C(N)c2ccccc2)CC1.Cl.Cl
InChIInChI=1S/C17H27N3O.2ClH/c1-2-20-12-9-14(10-13-20)8-11-19-17(21)16(18)15-6-4-3-5-7-15;;/h3-7,14,16H,2,8-13,18H2,1H3,(H,19,21);2*1H
InChIKeyBNWSJONQQFLGLB-UHFFFAOYSA-N
XLogP2.77
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.35
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2-cyclopentylethyl)-2-phenylacetamide;hydrochloride
CID 119289820
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CID 119885023
2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride
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2-amino-N-[(1-ethylpiperidin-4-yl)methyl]-2-(4-methylphenyl)acetamide
CID 106151685
2-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]-2-phenylacetamide
CID 61241817
2-amino-N-(2-cyclopropylethyl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668581
2-(1-ethylpiperidin-4-yl)ethylurea
CID 90844616
2-amino-N-[2-(2-methylcyclohexyl)ethyl]-2-phenylacetamide
CID 119323339
(2R)-2-amino-N-(1-ethylpiperidin-3-yl)-2-phenylacetamide
CID 61169816
3-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]benzamide;dihydrochloride
CID 119885053
2-amino-N-(2-morpholin-4-ylethyl)-2-phenylacetamide;dihydrochloride
CID 119827759
2-amino-2-phenyl-N-(2-thiomorpholin-4-ylethyl)acetamide;dihydrochloride
CID 119853604

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride?
The IUPAC name of 2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride (CID 119885013) is 2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride.
What is the SMILES notation for 2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride?
The canonical SMILES for 2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride is CCN1CCC(CCNC(=O)C(N)c2ccccc2)CC1.Cl.Cl.
What is the InChIKey of 2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride?
The InChIKey is BNWSJONQQFLGLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O.2ClH/c1-2-20-12-9-14(10-13-20)8-11-19-17(21)16(18)15-6-4-3-5-7-15;;/h3-7,14,16H,2,8-13,18H2,1H3,(H,19,21);2*1H.
What are the key properties of 2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride?
2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride has a molecular weight of 362.35 g/mol, XLogP of 2.77, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride is sourced from PubChem (CID 119885013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).