2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide

C14H21ClN2O — CID 110460951

IUPAC2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide
SMILESCC(C)(N)C(=O)NCC(C)(C)c1ccc(Cl)cc1
InChIInChI=1S/C14H21ClN2O/c1-13(2,9-17-12(18)14(3,4)16)10-5-7-11(15)8-6-10/h5-8H,9,16H2,1-4H3,(H,17,18)
InChIKeyLVNXDLOKLYKXSJ-UHFFFAOYSA-N
MW268.79 g/mol
LogP2.47
Rot. Bonds4

About 2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide

2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide (PubChem CID 110460951) has the molecular formula C14H21ClN2O and a molecular weight of 268.79 g/mol. Its IUPAC name is 2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide
PubChem CID110460951
Molecular FormulaC14H21ClN2O
Molecular Weight268.79 g/mol
Exact Mass268.13
IUPAC Name2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide
SMILESCC(C)(N)C(=O)NCC(C)(C)c1ccc(Cl)cc1
InChIInChI=1S/C14H21ClN2O/c1-13(2,9-17-12(18)14(3,4)16)10-5-7-11(15)8-6-10/h5-8H,9,16H2,1-4H3,(H,17,18)
InChIKeyLVNXDLOKLYKXSJ-UHFFFAOYSA-N
XLogP2.47
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.79
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-2-methylpropyl)-2-(4-chlorophenyl)-2-methylpropanamide
CID 119625738
N-[2-(4-chlorophenyl)-2-methylpropyl]-2-sulfanylacetamide
CID 115167558
(2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride
CID 119297367
3-chloro-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide
CID 110480800
methyl 2-[[2-(4-chlorophenyl)-2-methylpropyl]amino]-2-oxoacetate
CID 115142659
N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
CID 119738056
3-[2-(4-chlorophenyl)-2-methylpropyl]-1,1-diethylurea
CID 60547202
1-[(4-chlorophenyl)methyl]-3-[2-(4-chlorophenyl)-2-methylpropyl]urea
CID 113213436
1-[2-(4-chlorophenyl)-2-methylpropyl]-3-propan-2-ylurea
CID 47307554
7-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]heptanamide
CID 119738039
4-bromo-N-[2-(4-chlorophenyl)-2-methylpropyl]benzamide
CID 113090383
N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide
CID 119738068

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide?
The IUPAC name of 2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide (CID 110460951) is 2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide.
What is the SMILES notation for 2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide?
The canonical SMILES for 2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide is CC(C)(N)C(=O)NCC(C)(C)c1ccc(Cl)cc1.
What is the InChIKey of 2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide?
The InChIKey is LVNXDLOKLYKXSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN2O/c1-13(2,9-17-12(18)14(3,4)16)10-5-7-11(15)8-6-10/h5-8H,9,16H2,1-4H3,(H,17,18).
What are the key properties of 2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide?
2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide has a molecular weight of 268.79 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide is sourced from PubChem (CID 110460951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).