2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride

C19H25ClN4O2 — CID 120667005

IUPAC2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride
SMILESCc1ccc(C(N)C(=O)Nc2ccc(NC(=O)NC(C)C)cc2)cc1.Cl
InChIInChI=1S/C19H24N4O2.ClH/c1-12(2)21-19(25)23-16-10-8-15(9-11-16)22-18(24)17(20)14-6-4-13(3)5-7-14;/h4-12,17H,20H2,1-3H3,(H,22,24)(H2,21,23,25);1H
InChIKeyKBJVOHYGUDDGAE-UHFFFAOYSA-N
MW376.89 g/mol
LogP3.59
Rot. Bonds5

About 2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride

2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride (PubChem CID 120667005) has the molecular formula C19H25ClN4O2 and a molecular weight of 376.89 g/mol. Its IUPAC name is 2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride
PubChem CID120667005
Molecular FormulaC19H25ClN4O2
Molecular Weight376.89 g/mol
Exact Mass376.17
IUPAC Name2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride
SMILESCc1ccc(C(N)C(=O)Nc2ccc(NC(=O)NC(C)C)cc2)cc1.Cl
InChIInChI=1S/C19H24N4O2.ClH/c1-12(2)21-19(25)23-16-10-8-15(9-11-16)22-18(24)17(20)14-6-4-13(3)5-7-14;/h4-12,17H,20H2,1-3H3,(H,22,24)(H2,21,23,25);1H
InChIKeyKBJVOHYGUDDGAE-UHFFFAOYSA-N
XLogP3.59
TPSA96.25 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.89
LogP ≤ 53.59
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-(4-methylphenyl)-N-(4-propan-2-ylphenyl)acetamide;hydrochloride
CID 120666535
N-[4-[[2-amino-2-(4-methylphenyl)acetyl]amino]phenyl]-2-methylpropanamide
CID 120666693
1-[4-(1-aminoethyl)phenyl]-3-propan-2-ylurea
CID 43208686
N-[4-[[2-amino-2-(4-methylphenyl)acetyl]amino]phenyl]cyclopropanecarboxamide
CID 120666920
2-amino-N-[4-(azepane-1-carbonyl)phenyl]-2-(4-methylphenyl)acetamide;hydrochloride
CID 120667664
2-amino-N-[4-[2-(dimethylamino)-2-oxoethyl]phenyl]-2-(4-methylphenyl)acetamide;hydrochloride
CID 120667262
(2S)-2-amino-3,3-dimethyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]butanamide
CID 119704534
methyl 3-[4-[[2-amino-2-(4-methylphenyl)acetyl]amino]phenyl]propanoate;hydrochloride
CID 120668297
2-amino-N-[4-[[2-(azepan-1-yl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide
CID 120669658
2-amino-2-(4-methylphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide;hydrochloride
CID 120666734
1-(4-bromophenyl)-3-propan-2-ylurea
CID 3403454
2-amino-2-(4-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide;hydrochloride
CID 120667122

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride?
The IUPAC name of 2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride (CID 120667005) is 2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride.
What is the SMILES notation for 2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride?
The canonical SMILES for 2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride is Cc1ccc(C(N)C(=O)Nc2ccc(NC(=O)NC(C)C)cc2)cc1.Cl.
What is the InChIKey of 2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride?
The InChIKey is KBJVOHYGUDDGAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2.ClH/c1-12(2)21-19(25)23-16-10-8-15(9-11-16)22-18(24)17(20)14-6-4-13(3)5-7-14;/h4-12,17H,20H2,1-3H3,(H,22,24)(H2,21,23,25);1H.
What are the key properties of 2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride?
2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride has a molecular weight of 376.89 g/mol, XLogP of 3.59, 5 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(4-methylphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide;hydrochloride is sourced from PubChem (CID 120667005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).