N-[3-[methyl(2-methylpentyl)amino]propyl]formamide

C11H24N2O — CID 123854882

IUPACN-[3-[methyl(2-methylpentyl)amino]propyl]formamide
SMILESCCCC(C)CN(C)CCCNC=O
InChIInChI=1S/C11H24N2O/c1-4-6-11(2)9-13(3)8-5-7-12-10-14/h10-11H,4-9H2,1-3H3,(H,12,14)
InChIKeyUYMUVNUZKCXTSN-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.49
Rot. Bonds9

About N-[3-[methyl(2-methylpentyl)amino]propyl]formamide

N-[3-[methyl(2-methylpentyl)amino]propyl]formamide (PubChem CID 123854882) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is N-[3-[methyl(2-methylpentyl)amino]propyl]formamide.

Molecular Properties

Compound NameN-[3-[methyl(2-methylpentyl)amino]propyl]formamide
PubChem CID123854882
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC NameN-[3-[methyl(2-methylpentyl)amino]propyl]formamide
SMILESCCCC(C)CN(C)CCCNC=O
InChIInChI=1S/C11H24N2O/c1-4-6-11(2)9-13(3)8-5-7-12-10-14/h10-11H,4-9H2,1-3H3,(H,12,14)
InChIKeyUYMUVNUZKCXTSN-UHFFFAOYSA-N
XLogP1.49
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-dodecyl-N,2-dimethyldodecan-1-amine
CID 167511099
N-(2-methoxyethyl)-N'-methyl-N'-(2-methylpentyl)ethane-1,2-diamine
CID 62266935
(4R)-9-[methyl(2-methylpentyl)amino]nonane-1,4,6-triol
CID 137483974
N-[4-[methyl(propan-2-yl)amino]butyl]formamide
CID 64991998
N-[2-[hexyl(methyl)amino]ethyl]formamide
CID 54347817
ethane;N-pentylformamide
CID 145350301
N-tetracosylformamide
CID 54077607
N-pentacosylformamide
CID 88723962
N,2-dimethyl-N-[2-[2-(4-methylhexoxy)ethoxy]ethyl]pentan-1-amine
CID 170062056
N-(5-heptyltridecyl)formamide
CID 166649045
ethyl 3-[methyl(2-methylpentyl)amino]propanoate
CID 62265391
N'-methyl-N'-(2-methylpropyl)-N-propylpentane-1,5-diamine
CID 62421110

Frequently Asked Questions

What is the IUPAC name of N-[3-[methyl(2-methylpentyl)amino]propyl]formamide?
The IUPAC name of N-[3-[methyl(2-methylpentyl)amino]propyl]formamide (CID 123854882) is N-[3-[methyl(2-methylpentyl)amino]propyl]formamide.
What is the SMILES notation for N-[3-[methyl(2-methylpentyl)amino]propyl]formamide?
The canonical SMILES for N-[3-[methyl(2-methylpentyl)amino]propyl]formamide is CCCC(C)CN(C)CCCNC=O.
What is the InChIKey of N-[3-[methyl(2-methylpentyl)amino]propyl]formamide?
The InChIKey is UYMUVNUZKCXTSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-4-6-11(2)9-13(3)8-5-7-12-10-14/h10-11H,4-9H2,1-3H3,(H,12,14).
What are the key properties of N-[3-[methyl(2-methylpentyl)amino]propyl]formamide?
N-[3-[methyl(2-methylpentyl)amino]propyl]formamide has a molecular weight of 200.33 g/mol, XLogP of 1.49, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[methyl(2-methylpentyl)amino]propyl]formamide is sourced from PubChem (CID 123854882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).