4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine

C17H29N3 — CID 137169828

IUPAC4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine
SMILESCC=CC1=CN/C(=N/CCC2CCCCN2C)CC1C
InChIInChI=1S/C17H29N3/c1-4-7-15-13-19-17(12-14(15)2)18-10-9-16-8-5-6-11-20(16)3/h4,7,13-14,16H,5-6,8-12H2,1-3H3,(H,18,19)
InChIKeyYTNJLJORMMZJTC-UHFFFAOYSA-N
MW275.44 g/mol
LogP3.35
Rot. Bonds4

About 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine

4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine (PubChem CID 137169828) has the molecular formula C17H29N3 and a molecular weight of 275.44 g/mol. Its IUPAC name is 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine.

Molecular Properties

Compound Name4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine
PubChem CID137169828
Molecular FormulaC17H29N3
Molecular Weight275.44 g/mol
Exact Mass275.24
IUPAC Name4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine
SMILESCC=CC1=CN/C(=N/CCC2CCCCN2C)CC1C
InChIInChI=1S/C17H29N3/c1-4-7-15-13-19-17(12-14(15)2)18-10-9-16-8-5-6-11-20(16)3/h4,7,13-14,16H,5-6,8-12H2,1-3H3,(H,18,19)
InChIKeyYTNJLJORMMZJTC-UHFFFAOYSA-N
XLogP3.35
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-methyl-2-[(1-methylpiperidin-2-yl)methyl]piperidine
CID 54394556
(2R)-2-ethyl-1-methylpiperidine
CID 67552955
2-(2-cyclopentyloxyethyl)-1-methylpiperidine
CID 23339262
N-methyl-1-[1-[2-(1-methylpiperidin-2-yl)ethyl]pyrrol-2-yl]methanamine
CID 107913072
3-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]piperazine-2,6-dione
CID 114015239
ethane;N-[2-(1-methylpiperidin-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine
CID 161410894
3-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]piperidin-4-one
CID 107912283
4-chloro-N-[2-(1-methylpiperidin-2-yl)ethyl]aniline
CID 62413919
4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrrolidine-3-carboxylic acid
CID 55226113
(2S)-2-(2,2-dimethylpropyl)-1-methylpiperidine
CID 58874495
1-methyl-2-(2-pyrrolidin-1-ylethyl)pyrrolidine
CID 59939510
1-methyl-2-(2-phenoxyethyl)piperidine
CID 23339547

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine?
The IUPAC name of 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine (CID 137169828) is 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine.
What is the SMILES notation for 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine?
The canonical SMILES for 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine is CC=CC1=CN/C(=N/CCC2CCCCN2C)CC1C.
What is the InChIKey of 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine?
The InChIKey is YTNJLJORMMZJTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3/c1-4-7-15-13-19-17(12-14(15)2)18-10-9-16-8-5-6-11-20(16)3/h4,7,13-14,16H,5-6,8-12H2,1-3H3,(H,18,19).
What are the key properties of 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine?
4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine has a molecular weight of 275.44 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]-5-prop-1-enyl-3,4-dihydro-1H-pyridin-2-imine is sourced from PubChem (CID 137169828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).