N-methyl-N-(4-methylpentyl)formamide

C8H17NO — CID 54179007

IUPACN-methyl-N-(4-methylpentyl)formamide
SMILESCC(C)CCCN(C)C=O
InChIInChI=1S/C8H17NO/c1-8(2)5-4-6-9(3)7-10/h7-8H,4-6H2,1-3H3
InChIKeyLLCLTHPOLLKHEW-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.51
Rot. Bonds5

About N-methyl-N-(4-methylpentyl)formamide

N-methyl-N-(4-methylpentyl)formamide (PubChem CID 54179007) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is N-methyl-N-(4-methylpentyl)formamide.

Molecular Properties

Compound NameN-methyl-N-(4-methylpentyl)formamide
PubChem CID54179007
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC NameN-methyl-N-(4-methylpentyl)formamide
SMILESCC(C)CCCN(C)C=O
InChIInChI=1S/C8H17NO/c1-8(2)5-4-6-9(3)7-10/h7-8H,4-6H2,1-3H3
InChIKeyLLCLTHPOLLKHEW-UHFFFAOYSA-N
XLogP1.51
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
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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Related Compounds

ethane;N-methyl-N-(5-methylhexyl)formamide;1,1,1-trifluoroethane
CID 178007361
N,N-bis(4-methylpentyl)formamide
CID 23139123
N-(3-aminobutyl)-N-methylformamide
CID 90741055
N-(2-chloroethyl)-N-(4-methylpentyl)formamide
CID 178028720
N-methyl-N-tetradecylformamide
CID 10422507
N-iodo-N,4-dimethylpentan-1-amine
CID 147099385
N-methyl-N-[3-(propan-2-ylamino)butyl]formamide
CID 166777873
N-[(3R)-5-amino-3-methylpentyl]-N-methylformamide;ethane
CID 145154222
N-methyl-N-(4-methylpentyl)acetamide
CID 115191246
N-methyl-N-[2-(propan-2-ylamino)ethyl]formamide
CID 134385514
N-(2,3-dimethylbutyl)-N-methylformamide
CID 54514988
N-methyl-N-(2-sulfanylethyl)formamide
CID 139923648

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(4-methylpentyl)formamide?
The IUPAC name of N-methyl-N-(4-methylpentyl)formamide (CID 54179007) is N-methyl-N-(4-methylpentyl)formamide.
What is the SMILES notation for N-methyl-N-(4-methylpentyl)formamide?
The canonical SMILES for N-methyl-N-(4-methylpentyl)formamide is CC(C)CCCN(C)C=O.
What is the InChIKey of N-methyl-N-(4-methylpentyl)formamide?
The InChIKey is LLCLTHPOLLKHEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-8(2)5-4-6-9(3)7-10/h7-8H,4-6H2,1-3H3.
What are the key properties of N-methyl-N-(4-methylpentyl)formamide?
N-methyl-N-(4-methylpentyl)formamide has a molecular weight of 143.23 g/mol, XLogP of 1.51, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(4-methylpentyl)formamide is sourced from PubChem (CID 54179007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).