(2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine

C11H18N2 — CID 90918902

IUPAC(2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine
SMILESCC1CC=N/C(=C2\CCCNC2)C1
InChIInChI=1S/C11H18N2/c1-9-4-6-13-11(7-9)10-3-2-5-12-8-10/h6,9,12H,2-5,7-8H2,1H3/b11-10+
InChIKeyUQKNGHZXGLGULM-ZHACJKMWSA-N
MW178.28 g/mol
LogP2.12
Rot. Bonds

About (2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine

(2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine (PubChem CID 90918902) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is (2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine.

Molecular Properties

Compound Name(2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine
PubChem CID90918902
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name(2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine
SMILESCC1CC=N/C(=C2\CCCNC2)C1
InChIInChI=1S/C11H18N2/c1-9-4-6-13-11(7-9)10-3-2-5-12-8-10/h6,9,12H,2-5,7-8H2,1H3/b11-10+
InChIKeyUQKNGHZXGLGULM-ZHACJKMWSA-N
XLogP2.12
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3'-Bipyridine, 1',3,4,4',5,5',6,6'-octahydro-
CID 5373887
5-piperidin-2-ylidene-3,4-dihydro-2H-pyridine
CID 87404
4-(3H-pyrrol-5-ylmethyl)piperidine
CID 54520917
(4R)-4-methyl-6-piperidin-4-ylidene-4,5-dihydro-3H-pyridin-2-amine
CID 57241935
4-(4,5-dimethyl-3H-pyrrol-2-yl)piperidine
CID 58578279
6-Methyl-3-piperidin-4-yl-3,4-dihydropyridine
CID 69355119
4-(2,3-Dimethyl-2,3-dihydropyrrol-4-ylidene)piperidine
CID 90762439
2-Methyl-5-piperidin-4-yl-2,3-dihydropyridine
CID 123831605
2,5-Dimethyl-6-(pyrrolidin-3-ylmethyl)-1,2-dihydropyrazine
CID 135135279
N-[(3-ethyl-5-methyl-2,3-dihydropyridin-4-yl)methyl]propan-1-amine
CID 138576724
(Z)-4-imino-3-piperidin-3-ylbut-2-en-2-amine
CID 139358391
6-Piperidin-4-yl-3,4-dihydropyridine
CID 142892723

Frequently Asked Questions

What is the IUPAC name of (2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine?
The IUPAC name of (2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine (CID 90918902) is (2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine.
What is the SMILES notation for (2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine?
The canonical SMILES for (2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine is CC1CC=N/C(=C2\CCCNC2)C1.
What is the InChIKey of (2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine?
The InChIKey is UQKNGHZXGLGULM-ZHACJKMWSA-N. The full InChI is InChI=1S/C11H18N2/c1-9-4-6-13-11(7-9)10-3-2-5-12-8-10/h6,9,12H,2-5,7-8H2,1H3/b11-10+.
What are the key properties of (2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine?
(2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine has a molecular weight of 178.28 g/mol, XLogP of 2.12, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine is sourced from PubChem (CID 90918902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).