N,N-dimethyl-2-propyltriazinan-1-amine

C8H20N4 — CID 69202895

IUPACN,N-dimethyl-2-propyltriazinan-1-amine
SMILESCCCN1NCCCN1N(C)C
InChIInChI=1S/C8H20N4/c1-4-7-11-9-6-5-8-12(11)10(2)3/h9H,4-8H2,1-3H3
InChIKeyMNZPHWAAXSTGEA-UHFFFAOYSA-N
MW172.28 g/mol
LogP0.30
Rot. Bonds3

About N,N-dimethyl-2-propyltriazinan-1-amine

N,N-dimethyl-2-propyltriazinan-1-amine (PubChem CID 69202895) has the molecular formula C8H20N4 and a molecular weight of 172.28 g/mol. Its IUPAC name is N,N-dimethyl-2-propyltriazinan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-2-propyltriazinan-1-amine
PubChem CID69202895
Molecular FormulaC8H20N4
Molecular Weight172.28 g/mol
Exact Mass172.17
IUPAC NameN,N-dimethyl-2-propyltriazinan-1-amine
SMILESCCCN1NCCCN1N(C)C
InChIInChI=1S/C8H20N4/c1-4-7-11-9-6-5-8-12(11)10(2)3/h9H,4-8H2,1-3H3
InChIKeyMNZPHWAAXSTGEA-UHFFFAOYSA-N
XLogP0.30
TPSA21.75 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.28
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-propyltriazinan-1-amine?
The IUPAC name of N,N-dimethyl-2-propyltriazinan-1-amine (CID 69202895) is N,N-dimethyl-2-propyltriazinan-1-amine.
What is the SMILES notation for N,N-dimethyl-2-propyltriazinan-1-amine?
The canonical SMILES for N,N-dimethyl-2-propyltriazinan-1-amine is CCCN1NCCCN1N(C)C.
What is the InChIKey of N,N-dimethyl-2-propyltriazinan-1-amine?
The InChIKey is MNZPHWAAXSTGEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N4/c1-4-7-11-9-6-5-8-12(11)10(2)3/h9H,4-8H2,1-3H3.
What are the key properties of N,N-dimethyl-2-propyltriazinan-1-amine?
N,N-dimethyl-2-propyltriazinan-1-amine has a molecular weight of 172.28 g/mol, XLogP of 0.30, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-propyltriazinan-1-amine is sourced from PubChem (CID 69202895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).