2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine

C11H20N4 — CID 79064305

IUPAC2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine
SMILESCCC(C)(C(N)c1cncnc1)N(C)C
InChIInChI=1S/C11H20N4/c1-5-11(2,15(3)4)10(12)9-6-13-8-14-7-9/h6-8,10H,5,12H2,1-4H3
InChIKeyPWEGQGZLGCTXMC-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.21
Rot. Bonds4

About 2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine

2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine (PubChem CID 79064305) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine.

Molecular Properties

Compound Name2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine
PubChem CID79064305
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine
SMILESCCC(C)(C(N)c1cncnc1)N(C)C
InChIInChI=1S/C11H20N4/c1-5-11(2,15(3)4)10(12)9-6-13-8-14-7-9/h6-8,10H,5,12H2,1-4H3
InChIKeyPWEGQGZLGCTXMC-UHFFFAOYSA-N
XLogP1.21
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxy-2-methyl-1-pyrimidin-5-ylbutan-1-amine
CID 116758404
1-(2,6-difluorophenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine
CID 79063864
1-(2-amino-3-pyridinyl)-2-N,2-N,2-trimethylbutane-1,2-diamine
CID 79064575
1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine
CID 116810559
1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine
CID 102651812
(1-ethylcyclopentyl)-pyrimidin-5-ylmethanamine
CID 115827431
1-N,2-N,2-N,2-tetramethyl-1-pyrimidin-5-ylpropane-1,2-diamine
CID 79053495
1-[4-chloro-1-[2-(dimethylamino)ethyl]pyrazol-5-yl]-2-N,2-N,2-trimethylbutane-1,2-diamine
CID 114656737
1-hydrazinyl-N,N,2-trimethyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-2-amine
CID 105240684
2-methyl-1-pyrimidin-5-ylbutan-1-amine
CID 63719075
di(pyrimidin-5-yl)methanamine
CID 102923336
1-(4-amino-3-pyridinyl)-2-(dimethylamino)-2-methylbutan-1-ol
CID 79063613

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine?
The IUPAC name of 2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine (CID 79064305) is 2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine.
What is the SMILES notation for 2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine?
The canonical SMILES for 2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine is CCC(C)(C(N)c1cncnc1)N(C)C.
What is the InChIKey of 2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine?
The InChIKey is PWEGQGZLGCTXMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-5-11(2,15(3)4)10(12)9-6-13-8-14-7-9/h6-8,10H,5,12H2,1-4H3.
What are the key properties of 2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine?
2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine has a molecular weight of 208.31 g/mol, XLogP of 1.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,2-trimethyl-1-pyrimidin-5-ylbutane-1,2-diamine is sourced from PubChem (CID 79064305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).