4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine

C12H22N2 — CID 145316256

IUPAC4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine
SMILESC/C=C\NC1=NCCC(C)(C(C)C)C1
InChIInChI=1S/C12H22N2/c1-5-7-13-11-9-12(4,10(2)3)6-8-14-11/h5,7,10H,6,8-9H2,1-4H3,(H,13,14)/b7-5-
InChIKeySWHMKCSBEUPVJU-ALCCZGGFSA-N
MW194.32 g/mol
LogP2.96
Rot. Bonds2

About 4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine

4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine (PubChem CID 145316256) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine.

Molecular Properties

Compound Name4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine
PubChem CID145316256
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine
SMILESC/C=C\NC1=NCCC(C)(C(C)C)C1
InChIInChI=1S/C12H22N2/c1-5-7-13-11-9-12(4,10(2)3)6-8-14-11/h5,7,10H,6,8-9H2,1-4H3,(H,13,14)/b7-5-
InChIKeySWHMKCSBEUPVJU-ALCCZGGFSA-N
XLogP2.96
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 70240336
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N',2-dimethyl-N-[(Z)-prop-1-enyl]butanimidamide
CID 123792259
2-(4-Methylcyclohexyl)-1,4-dihydropyrimidine
CID 123843149
4-tert-butyl-N,N-dimethyl-3,4-dihydropyridin-2-amine
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N-ethyl-4-methyl-1,3,4,5-tetrahydroazepin-2-imine
CID 137149498
N'-methyl-N-[(Z)-prop-1-enyl]piperidine-3-carboximidamide
CID 153615523
2-(2,2-Dimethylpropyl)-1,4-dihydropyrimidine
CID 155051813
2-Heptan-4-yl-1,4-dihydropyrimidine
CID 167298107
N',3-dimethyl-N-[(Z)-prop-1-enyl]butanimidamide
CID 170580570
(3S)-N'-ethenyl-4-ethyl-3-methyl-6-(methylamino)hexanimidamide
CID 174089882
N-ethyl-1-propan-2-yl-3-azabicyclo[4.1.0]hept-4-en-2-imine
CID 143713226

Frequently Asked Questions

What is the IUPAC name of 4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine?
The IUPAC name of 4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine (CID 145316256) is 4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine.
What is the SMILES notation for 4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine?
The canonical SMILES for 4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine is C/C=C\NC1=NCCC(C)(C(C)C)C1.
What is the InChIKey of 4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine?
The InChIKey is SWHMKCSBEUPVJU-ALCCZGGFSA-N. The full InChI is InChI=1S/C12H22N2/c1-5-7-13-11-9-12(4,10(2)3)6-8-14-11/h5,7,10H,6,8-9H2,1-4H3,(H,13,14)/b7-5-.
What are the key properties of 4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine?
4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine has a molecular weight of 194.32 g/mol, XLogP of 2.96, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-4-propan-2-yl-N-[(Z)-prop-1-enyl]-3,5-dihydro-2H-pyridin-6-amine is sourced from PubChem (CID 145316256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).