ethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine

C13H26N2 — CID 166097117

IUPACethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine
SMILESC/C=C1/C(C)=CC=CN1NC.CC.CC
InChIInChI=1S/C9H14N2.2C2H6/c1-4-9-8(2)6-5-7-11(9)10-3;2*1-2/h4-7,10H,1-3H3;2*1-2H3/b9-4-;;
InChIKeyWIOBPVNUBBTZTL-FPAIPBCFSA-N
MW210.36 g/mol
LogP3.85
Rot. Bonds1

About ethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine

ethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine (PubChem CID 166097117) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is ethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine.

Molecular Properties

Compound Nameethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine
PubChem CID166097117
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Nameethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine
SMILESC/C=C1/C(C)=CC=CN1NC.CC.CC
InChIInChI=1S/C9H14N2.2C2H6/c1-4-9-8(2)6-5-7-11(9)10-3;2*1-2/h4-7,10H,1-3H3;2*1-2H3/b9-4-;;
InChIKeyWIOBPVNUBBTZTL-FPAIPBCFSA-N
XLogP3.85
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 171384060
N,N'-diaminoethyl-4,4'-bipyridyl
CID 129652186
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CID 129876735
3-fluoro-N,5-dimethyl-2-methylidenepyridin-1-amine
CID 147857381
3-(difluoromethyl)-N,5-dimethyl-2-methylidenepyridin-1-amine
CID 160896325
N,5-dimethyl-2-methylidene-3-(trifluoromethyl)pyridin-1-amine
CID 161823292
(5Z,7Z)-2,4,4-trimethyl-3-methylidene-1H-diazocine
CID 57786367
3,5-Dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine
CID 58047454
2,5-Dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine
CID 58047670
1-Propan-2-yl-2,3,6,7-tetrahydroindazole
CID 60067164
N,2-dimethyl-2H-pyridin-1-amine
CID 67204212
2,6-ditert-butyl-1H-pyridazine
CID 69060860

Frequently Asked Questions

What is the IUPAC name of ethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine?
The IUPAC name of ethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine (CID 166097117) is ethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine.
What is the SMILES notation for ethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine?
The canonical SMILES for ethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine is C/C=C1/C(C)=CC=CN1NC.CC.CC.
What is the InChIKey of ethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine?
The InChIKey is WIOBPVNUBBTZTL-FPAIPBCFSA-N. The full InChI is InChI=1S/C9H14N2.2C2H6/c1-4-9-8(2)6-5-7-11(9)10-3;2*1-2/h4-7,10H,1-3H3;2*1-2H3/b9-4-;;.
What are the key properties of ethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine?
ethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine has a molecular weight of 210.36 g/mol, XLogP of 3.85, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(2Z)-2-ethylidene-N,3-dimethylpyridin-1-amine is sourced from PubChem (CID 166097117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).