(2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane

C10H18N2 — CID 156744033

IUPAC(2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane
SMILESC=C(C)/C(C)=C1/NCCCN1C
InChIInChI=1S/C10H18N2/c1-8(2)9(3)10-11-6-5-7-12(10)4/h11H,1,5-7H2,2-4H3/b10-9-
InChIKeyNATDXANFRJELTN-KTKRTIGZSA-N
MW166.27 g/mol
LogP1.72
Rot. Bonds1

About (2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane

(2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane (PubChem CID 156744033) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is (2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane.

Molecular Properties

Compound Name(2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane
PubChem CID156744033
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name(2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane
SMILESC=C(C)/C(C)=C1/NCCCN1C
InChIInChI=1S/C10H18N2/c1-8(2)9(3)10-11-6-5-7-12(10)4/h11H,1,5-7H2,2-4H3/b10-9-
InChIKeyNATDXANFRJELTN-KTKRTIGZSA-N
XLogP1.72
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane?
The IUPAC name of (2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane (CID 156744033) is (2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane.
What is the SMILES notation for (2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane?
The canonical SMILES for (2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane is C=C(C)/C(C)=C1/NCCCN1C.
What is the InChIKey of (2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane?
The InChIKey is NATDXANFRJELTN-KTKRTIGZSA-N. The full InChI is InChI=1S/C10H18N2/c1-8(2)9(3)10-11-6-5-7-12(10)4/h11H,1,5-7H2,2-4H3/b10-9-.
What are the key properties of (2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane?
(2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane has a molecular weight of 166.27 g/mol, XLogP of 1.72, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane is sourced from PubChem (CID 156744033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).