N-(2-propan-2-ylphenyl)propanamide

C12H17NO — CID 723442

IUPACN-(2-propan-2-ylphenyl)propanamide
SMILESCCC(=O)Nc1ccccc1C(C)C
InChIInChI=1S/C12H17NO/c1-4-12(14)13-11-8-6-5-7-10(11)9(2)3/h5-9H,4H2,1-3H3,(H,13,14)
InChIKeyVFBOYFVZLQTFIP-UHFFFAOYSA-N
MW191.27 g/mol
LogP3.16
Rot. Bonds3

About N-(2-propan-2-ylphenyl)propanamide

N-(2-propan-2-ylphenyl)propanamide (PubChem CID 723442) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is N-(2-propan-2-ylphenyl)propanamide.

Molecular Properties

Compound NameN-(2-propan-2-ylphenyl)propanamide
PubChem CID723442
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC NameN-(2-propan-2-ylphenyl)propanamide
SMILESCCC(=O)Nc1ccccc1C(C)C
InChIInChI=1S/C12H17NO/c1-4-12(14)13-11-8-6-5-7-10(11)9(2)3/h5-9H,4H2,1-3H3,(H,13,14)
InChIKeyVFBOYFVZLQTFIP-UHFFFAOYSA-N
XLogP3.16
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-iodo-N-(2-propan-2-ylphenyl)acetamide
CID 4198881
1-N,2-N,3-N,4-N-tetrakis(2-propan-2-ylphenyl)butane-1,2,3,4-tetracarboxamide
CID 67992289
2-nitroso-N-(2-propan-2-ylphenyl)acetamide
CID 91475814
3-amino-N-(2-propan-2-ylphenyl)propanamide;hydrochloride
CID 71828995
N-(2-propan-2-ylphenyl)-2-(propylamino)acetamide
CID 54818713
4-amino-3-methyl-N-(2-propan-2-ylphenyl)butanamide
CID 81071847
4-amino-N-(2-propan-2-ylphenyl)pentanamide;hydrochloride
CID 120558713
2-methyl-5-oxo-5-(2-propan-2-ylanilino)pentanoic acid
CID 112517159
3-(butan-2-ylamino)-N-(2-propan-2-ylphenyl)propanamide
CID 109013163
N-[2-(1-hydroxyethyl)phenyl]butanamide
CID 43508507
methoxyethane;N-(2-propan-2-ylphenyl)acetamide
CID 161222349
5-chloro-N-(2-propan-2-ylphenyl)pentanamide
CID 28727835

Frequently Asked Questions

What is the IUPAC name of N-(2-propan-2-ylphenyl)propanamide?
The IUPAC name of N-(2-propan-2-ylphenyl)propanamide (CID 723442) is N-(2-propan-2-ylphenyl)propanamide.
What is the SMILES notation for N-(2-propan-2-ylphenyl)propanamide?
The canonical SMILES for N-(2-propan-2-ylphenyl)propanamide is CCC(=O)Nc1ccccc1C(C)C.
What is the InChIKey of N-(2-propan-2-ylphenyl)propanamide?
The InChIKey is VFBOYFVZLQTFIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-4-12(14)13-11-8-6-5-7-10(11)9(2)3/h5-9H,4H2,1-3H3,(H,13,14).
What are the key properties of N-(2-propan-2-ylphenyl)propanamide?
N-(2-propan-2-ylphenyl)propanamide has a molecular weight of 191.27 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 723442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).