N,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine

C12H28N2 — CID 22075519

IUPACN,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine
SMILESCCN(CC)CC(C)CN(CC)CC
InChIInChI=1S/C12H28N2/c1-6-13(7-2)10-12(5)11-14(8-3)9-4/h12H,6-11H2,1-5H3
InChIKeyLDGNVRTTXRQYRY-UHFFFAOYSA-N
MW200.37 g/mol
LogP2.31
Rot. Bonds8

About N,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine

N,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine (PubChem CID 22075519) has the molecular formula C12H28N2 and a molecular weight of 200.37 g/mol. Its IUPAC name is N,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine.

Molecular Properties

Compound NameN,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine
PubChem CID22075519
Molecular FormulaC12H28N2
Molecular Weight200.37 g/mol
Exact Mass200.23
IUPAC NameN,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine
SMILESCCN(CC)CC(C)CN(CC)CC
InChIInChI=1S/C12H28N2/c1-6-13(7-2)10-12(5)11-14(8-3)9-4/h12H,6-11H2,1-5H3
InChIKeyLDGNVRTTXRQYRY-UHFFFAOYSA-N
XLogP2.31
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.37
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine?
The IUPAC name of N,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine (CID 22075519) is N,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine.
What is the SMILES notation for N,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine?
The canonical SMILES for N,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine is CCN(CC)CC(C)CN(CC)CC.
What is the InChIKey of N,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine?
The InChIKey is LDGNVRTTXRQYRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N2/c1-6-13(7-2)10-12(5)11-14(8-3)9-4/h12H,6-11H2,1-5H3.
What are the key properties of N,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine?
N,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine has a molecular weight of 200.37 g/mol, XLogP of 2.31, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,N',N'-tetraethyl-2-methylpropane-1,3-diamine is sourced from PubChem (CID 22075519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).