N-methyl-N-[(2R)-2-methylbutyl]formamide

C7H15NO — CID 169181512

IUPACN-methyl-N-[(2R)-2-methylbutyl]formamide
SMILESCC[C@@H](C)CN(C)C=O
InChIInChI=1S/C7H15NO/c1-4-7(2)5-8(3)6-9/h6-7H,4-5H2,1-3H3/t7-/m1/s1
InChIKeyKYJMPHWVYLRLGA-SSDOTTSWSA-N
MW129.20 g/mol
LogP1.12
Rot. Bonds4

About N-methyl-N-[(2R)-2-methylbutyl]formamide

N-methyl-N-[(2R)-2-methylbutyl]formamide (PubChem CID 169181512) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is N-methyl-N-[(2R)-2-methylbutyl]formamide.

Molecular Properties

Compound NameN-methyl-N-[(2R)-2-methylbutyl]formamide
PubChem CID169181512
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC NameN-methyl-N-[(2R)-2-methylbutyl]formamide
SMILESCC[C@@H](C)CN(C)C=O
InChIInChI=1S/C7H15NO/c1-4-7(2)5-8(3)6-9/h6-7H,4-5H2,1-3H3/t7-/m1/s1
InChIKeyKYJMPHWVYLRLGA-SSDOTTSWSA-N
XLogP1.12
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Methylbutylformamide
CID 14230
N-formyl diisoamylamine
CID 19803158
N-Methyl-N-propylformamide
CID 19070644
N-methyl-N-(3-methylbutyl)carbamoyl fluoride
CID 89022465
N-butyl-N-ethylformamide
CID 12749099
N-methyl-N-(2-methylpropyl)formamide
CID 53694476
N-ethyl-N-(2-methylpropyl)formamide
CID 12622745
N-(3-methylbutyl)-N-(2-methylpropyl)formamide
CID 15936100
N-formyl-N-(2-methylpropyl)formamide
CID 18769156
Formyl-dimethyl-(2-methylpropyl)azanium
CID 19691395
3-Methylpyrrolidine-1-carbaldehyde
CID 20774103
3,4-Dimethylpyrrolidine-1-carbaldehyde
CID 21702851

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2R)-2-methylbutyl]formamide?
The IUPAC name of N-methyl-N-[(2R)-2-methylbutyl]formamide (CID 169181512) is N-methyl-N-[(2R)-2-methylbutyl]formamide.
What is the SMILES notation for N-methyl-N-[(2R)-2-methylbutyl]formamide?
The canonical SMILES for N-methyl-N-[(2R)-2-methylbutyl]formamide is CC[C@@H](C)CN(C)C=O.
What is the InChIKey of N-methyl-N-[(2R)-2-methylbutyl]formamide?
The InChIKey is KYJMPHWVYLRLGA-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H15NO/c1-4-7(2)5-8(3)6-9/h6-7H,4-5H2,1-3H3/t7-/m1/s1.
What are the key properties of N-methyl-N-[(2R)-2-methylbutyl]formamide?
N-methyl-N-[(2R)-2-methylbutyl]formamide has a molecular weight of 129.20 g/mol, XLogP of 1.12, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2R)-2-methylbutyl]formamide is sourced from PubChem (CID 169181512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).