N-(2,3-dimethylbutan-2-yl)-N-methylformamide

C8H17NO — CID 54132646

IUPACN-(2,3-dimethylbutan-2-yl)-N-methylformamide
SMILESCC(C)C(C)(C)N(C)C=O
InChIInChI=1S/C8H17NO/c1-7(2)8(3,4)9(5)6-10/h6-7H,1-5H3
InChIKeyFOBFRPKIGCVBOS-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.51
Rot. Bonds3

About N-(2,3-dimethylbutan-2-yl)-N-methylformamide

N-(2,3-dimethylbutan-2-yl)-N-methylformamide (PubChem CID 54132646) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is N-(2,3-dimethylbutan-2-yl)-N-methylformamide.

Molecular Properties

Compound NameN-(2,3-dimethylbutan-2-yl)-N-methylformamide
PubChem CID54132646
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC NameN-(2,3-dimethylbutan-2-yl)-N-methylformamide
SMILESCC(C)C(C)(C)N(C)C=O
InChIInChI=1S/C8H17NO/c1-7(2)8(3,4)9(5)6-10/h6-7H,1-5H3
InChIKeyFOBFRPKIGCVBOS-UHFFFAOYSA-N
XLogP1.51
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylbutan-2-yl)-N-methylformamide?
The IUPAC name of N-(2,3-dimethylbutan-2-yl)-N-methylformamide (CID 54132646) is N-(2,3-dimethylbutan-2-yl)-N-methylformamide.
What is the SMILES notation for N-(2,3-dimethylbutan-2-yl)-N-methylformamide?
The canonical SMILES for N-(2,3-dimethylbutan-2-yl)-N-methylformamide is CC(C)C(C)(C)N(C)C=O.
What is the InChIKey of N-(2,3-dimethylbutan-2-yl)-N-methylformamide?
The InChIKey is FOBFRPKIGCVBOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-7(2)8(3,4)9(5)6-10/h6-7H,1-5H3.
What are the key properties of N-(2,3-dimethylbutan-2-yl)-N-methylformamide?
N-(2,3-dimethylbutan-2-yl)-N-methylformamide has a molecular weight of 143.23 g/mol, XLogP of 1.51, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylbutan-2-yl)-N-methylformamide is sourced from PubChem (CID 54132646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).