N-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine

C9H16N2 — CID 169193514

IUPACN-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine
SMILESC=NN1CCCC(C)/C1=C/C
InChIInChI=1S/C9H16N2/c1-4-9-8(2)6-5-7-11(9)10-3/h4,8H,3,5-7H2,1-2H3/b9-4-
InChIKeyRSFAIDZRWCJMLU-WTKPLQERSA-N
MW152.24 g/mol
LogP2.24
Rot. Bonds1

About N-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine

N-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine (PubChem CID 169193514) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is N-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine.

Molecular Properties

Compound NameN-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine
PubChem CID169193514
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC NameN-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine
SMILESC=NN1CCCC(C)/C1=C/C
InChIInChI=1S/C9H16N2/c1-4-9-8(2)6-5-7-11(9)10-3/h4,8H,3,5-7H2,1-2H3/b9-4-
InChIKeyRSFAIDZRWCJMLU-WTKPLQERSA-N
XLogP2.24
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine 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

(Z)-N-butyl-7-methyl-N-(methylideneamino)oct-2-en-3-amine
CID 126567882
(Z)-7-methyl-N-(methylideneamino)-N-(4-methylpentyl)oct-2-en-3-amine
CID 126570427
(Z)-4,5-dimethyl-N-(methylideneamino)-N-propan-2-ylhept-2-en-3-amine
CID 138568185
N,N-dimethyl-N'-(methylideneamino)-N'-[(Z)-7-methyloct-2-en-3-yl]propane-1,3-diamine
CID 139335643
(5R)-3,3,5-trimethyl-5,6,7,8-tetrahydropyrido[1,2-b]pyridazine
CID 142321782
N-(5-methyl-2,3-dimethylidenepiperidin-1-yl)methanimine
CID 144804146
N-[(2Z)-2-ethylidenepiperidin-1-yl]methanimine
CID 156446432
(E)-N-[(2E)-2-ethylidenepiperidin-1-yl]ethanimine;methane
CID 166143534
(Z)-N-[(2Z)-2-ethylidenepiperidin-1-yl]ethanimine
CID 169587677
(5R)-3,3,5,8-tetramethyl-5,6,7,8-tetrahydropyrido[1,2-b]pyridazine
CID 173904322
(5R,8S)-3,3,5,8-tetramethyl-5,6,7,8-tetrahydropyrido[1,2-b]pyridazine
CID 174104334
2-Ethylidene-1,3-dimethylpiperidine
CID 151799463

Frequently Asked Questions

What is the IUPAC name of N-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine?
The IUPAC name of N-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine (CID 169193514) is N-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine.
What is the SMILES notation for N-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine?
The canonical SMILES for N-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine is C=NN1CCCC(C)/C1=C/C.
What is the InChIKey of N-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine?
The InChIKey is RSFAIDZRWCJMLU-WTKPLQERSA-N. The full InChI is InChI=1S/C9H16N2/c1-4-9-8(2)6-5-7-11(9)10-3/h4,8H,3,5-7H2,1-2H3/b9-4-.
What are the key properties of N-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine?
N-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine has a molecular weight of 152.24 g/mol, XLogP of 2.24, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2Z)-2-ethylidene-3-methylpiperidin-1-yl]methanimine is sourced from PubChem (CID 169193514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).