N,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine

C8H17N3 — CID 91041133

IUPACN,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine
SMILESC=C1CNC(N(C)C)NC1C
InChIInChI=1S/C8H17N3/c1-6-5-9-8(11(3)4)10-7(6)2/h7-10H,1,5H2,2-4H3
InChIKeyAPNZHWCHFGTVEI-UHFFFAOYSA-N
MW155.24 g/mol
LogP-0.03
Rot. Bonds1

About N,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine

N,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine (PubChem CID 91041133) has the molecular formula C8H17N3 and a molecular weight of 155.24 g/mol. Its IUPAC name is N,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine.

Molecular Properties

Compound NameN,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine
PubChem CID91041133
Molecular FormulaC8H17N3
Molecular Weight155.24 g/mol
Exact Mass155.14
IUPAC NameN,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine
SMILESC=C1CNC(N(C)C)NC1C
InChIInChI=1S/C8H17N3/c1-6-5-9-8(11(3)4)10-7(6)2/h7-10H,1,5H2,2-4H3
InChIKeyAPNZHWCHFGTVEI-UHFFFAOYSA-N
XLogP-0.03
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,6-dimethyl-3-methylidenepiperidin-2-amine
CID 90837651
4,6-Dimethyl-5-methylidene-1,3-diazinane
CID 91138135
5-methylidene-N-propan-2-ylpiperidin-2-amine
CID 91222372
5,6-Dimethyl-2-methylidene-3-propan-2-yl-1,6-dihydropyrimidine
CID 117797229
5-Methylidene-4-propan-2-yl-1,3-diazinane
CID 123147188
4-Methyl-5-methylidene-1,3-diazinan-2-amine
CID 123831195
4-N-methyl-4-N'-(3-methylbut-3-enyl)piperidine-4,4-diamine
CID 134389572
4,5-Bis(ethenyl)-1,3-diazinane;ethane
CID 142845495
(4S,5E)-4-methyl-5-(3-methylbut-2-enylidene)-1,3-diazinane
CID 155371528
(2Z)-1-methyl-2-(3-methylbut-3-en-2-ylidene)-1,3-diazinane;molecular hydrogen
CID 156744032
1-Pent-1-en-3-yl-1,3-diazinane
CID 174267488
N-(2-methylidenebutyl)-1-propylpiperidin-4-amine
CID 66044504

Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine?
The IUPAC name of N,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine (CID 91041133) is N,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine.
What is the SMILES notation for N,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine?
The canonical SMILES for N,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine is C=C1CNC(N(C)C)NC1C.
What is the InChIKey of N,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine?
The InChIKey is APNZHWCHFGTVEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3/c1-6-5-9-8(11(3)4)10-7(6)2/h7-10H,1,5H2,2-4H3.
What are the key properties of N,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine?
N,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine has a molecular weight of 155.24 g/mol, XLogP of -0.03, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethyl-5-methylidene-1,3-diazinan-2-amine is sourced from PubChem (CID 91041133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).