N-ethenyl-N-heptyl-N'-methylmethanimidamide

C11H22N2 — CID 144548032

IUPACN-ethenyl-N-heptyl-N'-methylmethanimidamide
SMILESC=CN(/C=N/C)CCCCCCC
InChIInChI=1S/C11H22N2/c1-4-6-7-8-9-10-13(5-2)11-12-3/h5,11H,2,4,6-10H2,1,3H3/b12-11+
InChIKeyKXICSAYXKCVFBR-VAWYXSNFSA-N
MW182.31 g/mol
LogP3.06
Rot. Bonds8

About N-ethenyl-N-heptyl-N'-methylmethanimidamide

N-ethenyl-N-heptyl-N'-methylmethanimidamide (PubChem CID 144548032) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is N-ethenyl-N-heptyl-N'-methylmethanimidamide.

Molecular Properties

Compound NameN-ethenyl-N-heptyl-N'-methylmethanimidamide
PubChem CID144548032
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC NameN-ethenyl-N-heptyl-N'-methylmethanimidamide
SMILESC=CN(/C=N/C)CCCCCCC
InChIInChI=1S/C11H22N2/c1-4-6-7-8-9-10-13(5-2)11-12-3/h5,11H,2,4,6-10H2,1,3H3/b12-11+
InChIKeyKXICSAYXKCVFBR-VAWYXSNFSA-N
XLogP3.06
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N-(3-aminopropyl)-N-ethenyl-N'-methylmethanimidamide
CID 142987772
N,N,N',N'-tetrakis(ethenyl)butane-1,4-diamine
CID 149434402
N-butyl-N-ethenylpentan-1-amine
CID 154960223
N-ethenyl-N-icosylhenicosanamide
CID 20565296
N,N-bis(prop-2-enyl)undecan-1-amine
CID 10156078
N'-[ethenyl(pentyl)amino]methanimidamide
CID 166768654
N-methyl-N-[(Z)-2-(methylideneamino)ethenyl]hexan-1-amine
CID 170063371
N-methyl-N-prop-2-enylhexadecan-1-amine
CID 100953658
N-ethenyl-N-propan-2-ylpentan-1-amine
CID 174943093
N,N-bis(prop-2-enyl)octadecan-1-amine;hydrochloride
CID 88725807
but-1-ene;ethane;N-heptyl-N-methylheptan-1-amine
CID 172567126
N,N'-didodecyl-N,N'-dioctylhexane-1,6-diamine
CID 154294870

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N-heptyl-N'-methylmethanimidamide?
The IUPAC name of N-ethenyl-N-heptyl-N'-methylmethanimidamide (CID 144548032) is N-ethenyl-N-heptyl-N'-methylmethanimidamide.
What is the SMILES notation for N-ethenyl-N-heptyl-N'-methylmethanimidamide?
The canonical SMILES for N-ethenyl-N-heptyl-N'-methylmethanimidamide is C=CN(/C=N/C)CCCCCCC.
What is the InChIKey of N-ethenyl-N-heptyl-N'-methylmethanimidamide?
The InChIKey is KXICSAYXKCVFBR-VAWYXSNFSA-N. The full InChI is InChI=1S/C11H22N2/c1-4-6-7-8-9-10-13(5-2)11-12-3/h5,11H,2,4,6-10H2,1,3H3/b12-11+.
What are the key properties of N-ethenyl-N-heptyl-N'-methylmethanimidamide?
N-ethenyl-N-heptyl-N'-methylmethanimidamide has a molecular weight of 182.31 g/mol, XLogP of 3.06, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N-heptyl-N'-methylmethanimidamide is sourced from PubChem (CID 144548032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).