N-[2-[hexyl(methyl)amino]ethyl]formamide

C10H22N2O — CID 54347817

IUPACN-[2-[hexyl(methyl)amino]ethyl]formamide
SMILESCCCCCCN(C)CCNC=O
InChIInChI=1S/C10H22N2O/c1-3-4-5-6-8-12(2)9-7-11-10-13/h10H,3-9H2,1-2H3,(H,11,13)
InChIKeyJSSHFRJNGYVBGJ-UHFFFAOYSA-N
MW186.30 g/mol
LogP1.24
Rot. Bonds9

About N-[2-[hexyl(methyl)amino]ethyl]formamide

N-[2-[hexyl(methyl)amino]ethyl]formamide (PubChem CID 54347817) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is N-[2-[hexyl(methyl)amino]ethyl]formamide.

Molecular Properties

Compound NameN-[2-[hexyl(methyl)amino]ethyl]formamide
PubChem CID54347817
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC NameN-[2-[hexyl(methyl)amino]ethyl]formamide
SMILESCCCCCCN(C)CCNC=O
InChIInChI=1S/C10H22N2O/c1-3-4-5-6-8-12(2)9-7-11-10-13/h10H,3-9H2,1-2H3,(H,11,13)
InChIKeyJSSHFRJNGYVBGJ-UHFFFAOYSA-N
XLogP1.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.24
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'}

Analyze N-[2-[hexyl(methyl)amino]ethyl]formamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-tetracosylformamide
CID 54077607
N-pentacosylformamide
CID 88723962
N'-decyl-N-ethyl-N'-methylethane-1,2-diamine
CID 63526975
N'-butyl-N'-methyl-N-pentylbutane-1,4-diamine
CID 170176029
N-methyl-N-tridecyltetradecan-1-amine
CID 87351995
N-methyl-N-octylundecan-1-amine
CID 140654810
N-hexyl-N-methyldodecan-1-amine
CID 139978744
N-dodecyl-N-methyldodecan-1-amine;tetradecane
CID 118268401
N-hexadecyl-N-methylicosan-1-amine
CID 21242596
N,N'-dimethyl-N,N'-dioctyldecane-1,10-diamine
CID 19772875
N-methyl-N-octadecyloctadecan-1-amine;N-methyl-N-tetradecyltetradecan-1-amine
CID 172776346
N-methyl-N-nonylundecan-1-amine
CID 603442

Frequently Asked Questions

What is the IUPAC name of N-[2-[hexyl(methyl)amino]ethyl]formamide?
The IUPAC name of N-[2-[hexyl(methyl)amino]ethyl]formamide (CID 54347817) is N-[2-[hexyl(methyl)amino]ethyl]formamide.
What is the SMILES notation for N-[2-[hexyl(methyl)amino]ethyl]formamide?
The canonical SMILES for N-[2-[hexyl(methyl)amino]ethyl]formamide is CCCCCCN(C)CCNC=O.
What is the InChIKey of N-[2-[hexyl(methyl)amino]ethyl]formamide?
The InChIKey is JSSHFRJNGYVBGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-3-4-5-6-8-12(2)9-7-11-10-13/h10H,3-9H2,1-2H3,(H,11,13).
What are the key properties of N-[2-[hexyl(methyl)amino]ethyl]formamide?
N-[2-[hexyl(methyl)amino]ethyl]formamide has a molecular weight of 186.30 g/mol, XLogP of 1.24, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[hexyl(methyl)amino]ethyl]formamide is sourced from PubChem (CID 54347817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).