2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride

C19H26ClN3O — CID 120622112

IUPAC2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride
SMILESCC(C)c1ccc(NC(=O)Cc2ccc(N)cn2)c(C(C)C)c1.Cl
InChIInChI=1S/C19H25N3O.ClH/c1-12(2)14-5-8-18(17(9-14)13(3)4)22-19(23)10-16-7-6-15(20)11-21-16;/h5-9,11-13H,10,20H2,1-4H3,(H,22,23);1H
InChIKeyKWDNLUHULHOPPY-UHFFFAOYSA-N
MW347.89 g/mol
LogP4.51
Rot. Bonds5

About 2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride

2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride (PubChem CID 120622112) has the molecular formula C19H26ClN3O and a molecular weight of 347.89 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride
PubChem CID120622112
Molecular FormulaC19H26ClN3O
Molecular Weight347.89 g/mol
Exact Mass347.18
IUPAC Name2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride
SMILESCC(C)c1ccc(NC(=O)Cc2ccc(N)cn2)c(C(C)C)c1.Cl
InChIInChI=1S/C19H25N3O.ClH/c1-12(2)14-5-8-18(17(9-14)13(3)4)22-19(23)10-16-7-6-15(20)11-21-16;/h5-9,11-13H,10,20H2,1-4H3,(H,22,23);1H
InChIKeyKWDNLUHULHOPPY-UHFFFAOYSA-N
XLogP4.51
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.89
LogP ≤ 54.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-amino-2-pyridinyl)-N-(4-propan-2-ylphenyl)acetamide
CID 107337408
2-(5-amino-2-pyridinyl)-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride
CID 120617873
2-(5-amino-2-pyridinyl)-N-(2,4,5-trichlorophenyl)acetamide
CID 107337386
3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide
CID 43705485
4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide
CID 107337787
2-(5-amino-2-pyridinyl)-N-(2-hydroxyphenyl)acetamide
CID 107338919
4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-chlorobenzoic acid
CID 107338917
2-(5-amino-2-pyridinyl)-N-(5-fluoro-2-methylphenyl)acetamide
CID 107337459
(2S)-2-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide;hydrochloride
CID 119288317
N-(4-acetamidophenyl)-2-(5-amino-2-pyridinyl)acetamide
CID 107337507
5-chloro-N-[2,4-di(propan-2-yl)phenyl]pentanamide
CID 43698416
2-[2-[[2-(5-amino-2-pyridinyl)acetyl]amino]phenyl]acetic acid
CID 107338676

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride (CID 120622112) is 2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride is CC(C)c1ccc(NC(=O)Cc2ccc(N)cn2)c(C(C)C)c1.Cl.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride?
The InChIKey is KWDNLUHULHOPPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O.ClH/c1-12(2)14-5-8-18(17(9-14)13(3)4)22-19(23)10-16-7-6-15(20)11-21-16;/h5-9,11-13H,10,20H2,1-4H3,(H,22,23);1H.
What are the key properties of 2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride?
2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride has a molecular weight of 347.89 g/mol, XLogP of 4.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride is sourced from PubChem (CID 120622112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).