1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane

C9H16N2 — CID 89468959

IUPAC1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane
SMILESC=C1N(C)CCCN1/C=C\C
InChIInChI=1S/C9H16N2/c1-4-6-11-8-5-7-10(3)9(11)2/h4,6H,2,5,7-8H2,1,3H3/b6-4-
InChIKeyPXLIFQNDOKMDIP-XQRVVYSFSA-N
MW152.24 g/mol
LogP1.63
Rot. Bonds1

About 1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane

1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane (PubChem CID 89468959) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane.

Molecular Properties

Compound Name1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane
PubChem CID89468959
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane
SMILESC=C1N(C)CCCN1/C=C\C
InChIInChI=1S/C9H16N2/c1-4-6-11-8-5-7-10(3)9(11)2/h4,6H,2,5,7-8H2,1,3H3/b6-4-
InChIKeyPXLIFQNDOKMDIP-XQRVVYSFSA-N
XLogP1.63
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane?
The IUPAC name of 1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane (CID 89468959) is 1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane.
What is the SMILES notation for 1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane?
The canonical SMILES for 1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane is C=C1N(C)CCCN1/C=C\C.
What is the InChIKey of 1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane?
The InChIKey is PXLIFQNDOKMDIP-XQRVVYSFSA-N. The full InChI is InChI=1S/C9H16N2/c1-4-6-11-8-5-7-10(3)9(11)2/h4,6H,2,5,7-8H2,1,3H3/b6-4-.
What are the key properties of 1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane?
1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane has a molecular weight of 152.24 g/mol, XLogP of 1.63, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-methylidene-3-[(Z)-prop-1-enyl]-1,3-diazinane is sourced from PubChem (CID 89468959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).