N,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide

C18H38N2O2 — CID 165001627

IUPACN,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide
SMILESCC(C)CC(=O)N(C)C(C)C.CC(C)CN(C)C(=O)C(C)C
InChIInChI=1S/2C9H19NO/c1-7(2)6-10(5)9(11)8(3)4;1-7(2)6-9(11)10(5)8(3)4/h2*7-8H,6H2,1-5H3
InChIKeyIIGYVXCBOBQFHI-UHFFFAOYSA-N
MW314.51 g/mol
LogP3.66
Rot. Bonds6

About N,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide

N,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide (PubChem CID 165001627) has the molecular formula C18H38N2O2 and a molecular weight of 314.51 g/mol. Its IUPAC name is N,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide.

Molecular Properties

Compound NameN,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide
PubChem CID165001627
Molecular FormulaC18H38N2O2
Molecular Weight314.51 g/mol
Exact Mass314.29
IUPAC NameN,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide
SMILESCC(C)CC(=O)N(C)C(C)C.CC(C)CN(C)C(=O)C(C)C
InChIInChI=1S/2C9H19NO/c1-7(2)6-10(5)9(11)8(3)4;1-7(2)6-9(11)10(5)8(3)4/h2*7-8H,6H2,1-5H3
InChIKeyIIGYVXCBOBQFHI-UHFFFAOYSA-N
XLogP3.66
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.51
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-Dimethyl-1,4-bis(3-methylbutanoyl)piperazine
CID 2931940
N,N-Diethyl-3-methylbutanamide
CID 68290
N,N,N',N'-tetrakis(3-methylbutyl)propanediamide
CID 3721575
Methylbutanoyl 2-methylbutylamine
CID 21263621
Methylbutanoyl 3-methylbutylamine
CID 60738361
N,N-diisovaleroyl isoamylamine
CID 129775823
3-Methyl-n,n-dipropylbutanamide
CID 233648
N,N-diethyl-2-methylbutanamide
CID 4630306
N,3-dimethyl-N-(2-methylpropyl)butanamide
CID 58845666
N-butan-2-yl-N-butyl-2-methylpropanamide
CID 60744532
N-butan-2-yl-3-methyl-N-(3-methylbutyl)butanamide
CID 132083237
N-butan-2-yl-N-ethyl-3-methylbutanamide
CID 142558393

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide?
The IUPAC name of N,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide (CID 165001627) is N,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide.
What is the SMILES notation for N,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide?
The canonical SMILES for N,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide is CC(C)CC(=O)N(C)C(C)C.CC(C)CN(C)C(=O)C(C)C.
What is the InChIKey of N,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide?
The InChIKey is IIGYVXCBOBQFHI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H19NO/c1-7(2)6-10(5)9(11)8(3)4;1-7(2)6-9(11)10(5)8(3)4/h2*7-8H,6H2,1-5H3.
What are the key properties of N,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide?
N,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide has a molecular weight of 314.51 g/mol, XLogP of 3.66, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(2-methylpropyl)propanamide;N,3-dimethyl-N-propan-2-ylbutanamide is sourced from PubChem (CID 165001627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).