2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride

C19H24ClN3O — CID 120621354

IUPAC2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride
SMILESCCc1ccc(CN(C(=O)Cc2ccc(N)cn2)C2CC2)cc1.Cl
InChIInChI=1S/C19H23N3O.ClH/c1-2-14-3-5-15(6-4-14)13-22(18-9-10-18)19(23)11-17-8-7-16(20)12-21-17;/h3-8,12,18H,2,9-11,13,20H2,1H3;1H
InChIKeySIXCKDHTOSGOHA-UHFFFAOYSA-N
MW345.87 g/mol
LogP3.38
Rot. Bonds6

About 2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride

2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride (PubChem CID 120621354) has the molecular formula C19H24ClN3O and a molecular weight of 345.87 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride
PubChem CID120621354
Molecular FormulaC19H24ClN3O
Molecular Weight345.87 g/mol
Exact Mass345.16
IUPAC Name2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride
SMILESCCc1ccc(CN(C(=O)Cc2ccc(N)cn2)C2CC2)cc1.Cl
InChIInChI=1S/C19H23N3O.ClH/c1-2-14-3-5-15(6-4-14)13-22(18-9-10-18)19(23)11-17-8-7-16(20)12-21-17;/h3-8,12,18H,2,9-11,13,20H2,1H3;1H
InChIKeySIXCKDHTOSGOHA-UHFFFAOYSA-N
XLogP3.38
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.87
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 107338030
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CID 107337433
2-(5-amino-2-pyridinyl)-N-(cyclopropylmethyl)-N-ethylacetamide;hydrochloride
CID 120632760
2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride
CID 120616165
2-(5-amino-2-pyridinyl)-N-benzyl-N-(1-cyclopropylethyl)acetamide;hydrochloride
CID 120617047
2-(5-amino-2-pyridinyl)-1-[4-(dimethylamino)piperidin-1-yl]ethanone;dihydrochloride
CID 120647975
4-amino-N-cyclopropyl-N-[(4-ethylphenyl)methyl]butanamide
CID 54870516
3-(2-aminophenyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]propanamide
CID 120608816
2-(5-amino-2-pyridinyl)-N-ethyl-N-propan-2-ylacetamide;hydrochloride
CID 120620159
2-(5-amino-2-pyridinyl)-N-benzyl-N-butan-2-ylacetamide
CID 120618159
2-(5-amino-2-pyridinyl)-N-ethyl-N-(oxolan-2-ylmethyl)acetamide;hydrochloride
CID 120625769
N-[(4-aminophenyl)methyl]-2-cyclobutyl-N-cyclopropylacetamide
CID 103161534

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride (CID 120621354) is 2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride is CCc1ccc(CN(C(=O)Cc2ccc(N)cn2)C2CC2)cc1.Cl.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride?
The InChIKey is SIXCKDHTOSGOHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O.ClH/c1-2-14-3-5-15(6-4-14)13-22(18-9-10-18)19(23)11-17-8-7-16(20)12-21-17;/h3-8,12,18H,2,9-11,13,20H2,1H3;1H.
What are the key properties of 2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride?
2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride has a molecular weight of 345.87 g/mol, XLogP of 3.38, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride is sourced from PubChem (CID 120621354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).