N-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine

C12H22N2 — CID 143696033

IUPACN-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine
SMILESC/C=C(CC)\N=C(/C)N1CCCCC1
InChIInChI=1S/C12H22N2/c1-4-12(5-2)13-11(3)14-9-7-6-8-10-14/h4H,5-10H2,1-3H3/b12-4-,13-11+
InChIKeyRQVQFYATSYVCGZ-SXAQCRNGSA-N
MW194.32 g/mol
LogP3.20
Rot. Bonds2

About N-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine

N-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine (PubChem CID 143696033) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is N-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine.

Molecular Properties

Compound NameN-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine
PubChem CID143696033
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC NameN-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine
SMILESC/C=C(CC)\N=C(/C)N1CCCCC1
InChIInChI=1S/C12H22N2/c1-4-12(5-2)13-11(3)14-9-7-6-8-10-14/h4H,5-10H2,1-3H3/b12-4-,13-11+
InChIKeyRQVQFYATSYVCGZ-SXAQCRNGSA-N
XLogP3.20
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N'-but-2-ynyl-N-(cyclohexen-1-yl)-N-methylethanimidamide
CID 137427688
ethane;N-[(2Z,4E)-3-methylhexa-2,4-dien-2-yl]-1-piperidin-1-ylethanimine
CID 142064525
N,N-dimethyl-N'-[(E)-pent-2-en-2-yl]pentanimidamide;prop-1-ene
CID 142994752
ethane;7-piperidin-1-yl-4H-azepine
CID 144801123
1-[5-(chloromethyl)-3-methyl-3H-pyrrol-2-yl]piperidine
CID 146544681
N-methyl-1-(2-methylidenepiperidin-1-yl)propan-1-imine
CID 155700723
N,N-diethyl-6-methyl-3,4-dihydropyridin-2-amine
CID 156227017
N'-methyl-N-[(Z)-7-piperidin-1-ylhept-2-en-3-yl]ethanimidamide
CID 156234114
N'-but-1-en-2-yl-N-methyl-N-[(Z)-pent-3-enyl]propanimidamide
CID 166814571
N-ethyl-N-methyl-N'-[(E)-pent-2-en-2-yl]ethanimidamide
CID 167083154
1-methyl-N-prop-1-en-2-ylpiperidin-2-imine
CID 167098890
N-[(2Z,4E)-3-methylhexa-2,4-dien-2-yl]-1-piperidin-1-ylethanimine
CID 142064526

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine?
The IUPAC name of N-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine (CID 143696033) is N-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine.
What is the SMILES notation for N-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine?
The canonical SMILES for N-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine is C/C=C(CC)\N=C(/C)N1CCCCC1.
What is the InChIKey of N-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine?
The InChIKey is RQVQFYATSYVCGZ-SXAQCRNGSA-N. The full InChI is InChI=1S/C12H22N2/c1-4-12(5-2)13-11(3)14-9-7-6-8-10-14/h4H,5-10H2,1-3H3/b12-4-,13-11+.
What are the key properties of N-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine?
N-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine has a molecular weight of 194.32 g/mol, XLogP of 3.20, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-pent-2-en-3-yl]-1-piperidin-1-ylethanimine is sourced from PubChem (CID 143696033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).