N-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide

C14H29NO — CID 167343079

IUPACN-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide
SMILESCC(C)C(=O)N(C(C)C)C(C(C)C)C(C)C
InChIInChI=1S/C14H29NO/c1-9(2)13(10(3)4)15(12(7)8)14(16)11(5)6/h9-13H,1-8H3
InChIKeyJJWJIZROSLTRIH-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.56
Rot. Bonds5

About N-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide

N-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide (PubChem CID 167343079) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is N-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide.

Molecular Properties

Compound NameN-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide
PubChem CID167343079
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC NameN-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide
SMILESCC(C)C(=O)N(C(C)C)C(C(C)C)C(C)C
InChIInChI=1S/C14H29NO/c1-9(2)13(10(3)4)15(12(7)8)14(16)11(5)6/h9-13H,1-8H3
InChIKeyJJWJIZROSLTRIH-UHFFFAOYSA-N
XLogP3.56
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-deuterio-2-methyl-N,N-di(propan-2-yl)propanamide
CID 11457949
(2S)-2-amino-3-methyl-N-(3-methylbutan-2-yl)-N-propan-2-ylbutanamide
CID 59033207
N-cyclopropyl-2-methyl-N-propan-2-ylpropanamide
CID 110872845
lithium;hydride;bis(2-methylpropanoic acid)
CID 175577602
tris(di(propan-2-yl)carbamic acid);titanium
CID 11812839
2-methylpropanoic acid
CID 173073412
N-ethyl-2-methyl-N-propan-2-ylpropanamide
CID 157175110
(Z,2R)-2,3-dimethyl-N,N-di(propan-2-yl)pent-3-enamide
CID 14921251
2-hydroxy-N,N-di(propan-2-yl)butanamide
CID 71365964
(2R,3S,4S)-4-hydroxy-2,3-dimethyl-N,N-di(propan-2-yl)pentanamide
CID 10988048
(Z,2S)-2,3-dimethyl-N,N-di(propan-2-yl)pent-3-enamide
CID 101053961
S-chloro N,N-di(propan-2-yl)carbamothioate
CID 20975381

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide?
The IUPAC name of N-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide (CID 167343079) is N-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide.
What is the SMILES notation for N-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide?
The canonical SMILES for N-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide is CC(C)C(=O)N(C(C)C)C(C(C)C)C(C)C.
What is the InChIKey of N-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide?
The InChIKey is JJWJIZROSLTRIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-9(2)13(10(3)4)15(12(7)8)14(16)11(5)6/h9-13H,1-8H3.
What are the key properties of N-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide?
N-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide has a molecular weight of 227.39 g/mol, XLogP of 3.56, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylpentan-3-yl)-2-methyl-N-propan-2-ylpropanamide is sourced from PubChem (CID 167343079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).