N-(2-methyl-4-phosphanylbutan-2-yl)formamide

C6H14NOP — CID 142361744

IUPACN-(2-methyl-4-phosphanylbutan-2-yl)formamide
SMILESCC(C)(CCP)NC=O
InChIInChI=1S/C6H14NOP/c1-6(2,3-4-9)7-5-8/h5H,3-4,9H2,1-2H3,(H,7,8)
InChIKeyWQQXDMJMQBKUHP-UHFFFAOYSA-N
MW147.16 g/mol
LogP0.78
Rot. Bonds4

About N-(2-methyl-4-phosphanylbutan-2-yl)formamide

N-(2-methyl-4-phosphanylbutan-2-yl)formamide (PubChem CID 142361744) has the molecular formula C6H14NOP and a molecular weight of 147.16 g/mol. Its IUPAC name is N-(2-methyl-4-phosphanylbutan-2-yl)formamide.

Molecular Properties

Compound NameN-(2-methyl-4-phosphanylbutan-2-yl)formamide
PubChem CID142361744
Molecular FormulaC6H14NOP
Molecular Weight147.16 g/mol
Exact Mass147.08
IUPAC NameN-(2-methyl-4-phosphanylbutan-2-yl)formamide
SMILESCC(C)(CCP)NC=O
InChIInChI=1S/C6H14NOP/c1-6(2,3-4-9)7-5-8/h5H,3-4,9H2,1-2H3,(H,7,8)
InChIKeyWQQXDMJMQBKUHP-UHFFFAOYSA-N
XLogP0.78
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.16
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(1-fluoro-2-methylpropan-2-yl)formamide
CID 14806739
N-(12-chloro-2-methyldodecan-2-yl)formamide
CID 71601715
N-[4-(1-amino-2-methylpropan-2-yl)oxy-2-methylbutan-2-yl]formamide
CID 166659477
N-[4-(2-iodoethoxy)-2-methylbutan-2-yl]formamide
CID 155174619
N-(2,4-dimethyl-4-sulfanylpentan-2-yl)formamide
CID 89377125
N-[2-methyl-4-(propan-2-ylsulfamoyl)butan-2-yl]formamide
CID 146492904
N-(4-methylheptan-4-yl)formamide
CID 54483706
N-tert-butylformamide;ethane
CID 142078215
N-[1-(2-amino-2-methylpropoxy)-2-methylpropan-2-yl]formamide
CID 170966497
N-[1-(3,5-dimethylphenyl)-2-methylpropan-2-yl]formamide
CID 86078614
N-(1,1-dihydroxyethyl)formamide
CID 87394549
N-[4-[4-(methanesulfonamido)phenyl]-2-methylbutan-2-yl]formamide
CID 88730159

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-4-phosphanylbutan-2-yl)formamide?
The IUPAC name of N-(2-methyl-4-phosphanylbutan-2-yl)formamide (CID 142361744) is N-(2-methyl-4-phosphanylbutan-2-yl)formamide.
What is the SMILES notation for N-(2-methyl-4-phosphanylbutan-2-yl)formamide?
The canonical SMILES for N-(2-methyl-4-phosphanylbutan-2-yl)formamide is CC(C)(CCP)NC=O.
What is the InChIKey of N-(2-methyl-4-phosphanylbutan-2-yl)formamide?
The InChIKey is WQQXDMJMQBKUHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14NOP/c1-6(2,3-4-9)7-5-8/h5H,3-4,9H2,1-2H3,(H,7,8).
What are the key properties of N-(2-methyl-4-phosphanylbutan-2-yl)formamide?
N-(2-methyl-4-phosphanylbutan-2-yl)formamide has a molecular weight of 147.16 g/mol, XLogP of 0.78, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-4-phosphanylbutan-2-yl)formamide is sourced from PubChem (CID 142361744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).