N,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane

C12H24N2 — CID 142616651

IUPACN,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane
SMILESC/N=C1\CC(C)C=CN1C(C)C.CC
InChIInChI=1S/C10H18N2.C2H6/c1-8(2)12-6-5-9(3)7-10(12)11-4;1-2/h5-6,8-9H,7H2,1-4H3;1-2H3/b11-10+;
InChIKeyZFDPYACPTMXGOE-ASTDGNLGSA-N
MW196.34 g/mol
LogP3.30
Rot. Bonds1

About N,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane

N,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane (PubChem CID 142616651) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane.

Molecular Properties

Compound NameN,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane
PubChem CID142616651
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane
SMILESC/N=C1\CC(C)C=CN1C(C)C.CC
InChIInChI=1S/C10H18N2.C2H6/c1-8(2)12-6-5-9(3)7-10(12)11-4;1-2/h5-6,8-9H,7H2,1-4H3;1-2H3/b11-10+;
InChIKeyZFDPYACPTMXGOE-ASTDGNLGSA-N
XLogP3.30
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-ethenyl-N'-ethyl-N-(5-fluoro-2-methylhept-4-en-3-yl)propanimidamide
CID 173863398
3,5-diethyl-4-methyl-2-propan-2-yl-4H-pyrimidine
CID 17805658
N-cyclohexyl-N-methyl-3,4-dihydropyridin-2-amine
CID 57112228
1,5-diethyl-4-methyl-2-propan-2-yl-4H-pyrimidine
CID 57308003
N,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine
CID 70579189
N-ethyl-N,3-dimethyl-4,5-dihydro-3H-azepin-2-amine
CID 91491983
N-butyl-3-methyl-N-propyl-3,4-dihydropyridin-2-amine
CID 123537710
2-Methyl-2,3,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 123759322
9-methyl-8,9-dihydro-4H-pyrido[1,2-a]pyrimidine
CID 135245105
N-methyl-1-[(E)-3-methylbut-1-enyl]piperidin-2-imine
CID 137413297
N,1-di(propan-2-yl)-3H-pyrrol-2-imine
CID 138726875
ethane;N'-[(1Z)-2-ethylbuta-1,3-dienyl]-2-methyl-N,N-dipropylbutanimidamide
CID 142121541

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane?
The IUPAC name of N,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane (CID 142616651) is N,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane.
What is the SMILES notation for N,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane?
The canonical SMILES for N,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane is C/N=C1\CC(C)C=CN1C(C)C.CC.
What is the InChIKey of N,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane?
The InChIKey is ZFDPYACPTMXGOE-ASTDGNLGSA-N. The full InChI is InChI=1S/C10H18N2.C2H6/c1-8(2)12-6-5-9(3)7-10(12)11-4;1-2/h5-6,8-9H,7H2,1-4H3;1-2H3/b11-10+;.
What are the key properties of N,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane?
N,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane has a molecular weight of 196.34 g/mol, XLogP of 3.30, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-1-propan-2-yl-3,4-dihydropyridin-2-imine;ethane is sourced from PubChem (CID 142616651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).