2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine

C14H26N4 — CID 114011099

IUPAC2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine
SMILESCC(C)CCN(CCC(C)C)c1ncc(N)cn1
InChIInChI=1S/C14H26N4/c1-11(2)5-7-18(8-6-12(3)4)14-16-9-13(15)10-17-14/h9-12H,5-8,15H2,1-4H3
InChIKeyWIOISGOAABPSQX-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.96
Rot. Bonds7

About 2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine

2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine (PubChem CID 114011099) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine.

Molecular Properties

Compound Name2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine
PubChem CID114011099
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine
SMILESCC(C)CCN(CCC(C)C)c1ncc(N)cn1
InChIInChI=1S/C14H26N4/c1-11(2)5-7-18(8-6-12(3)4)14-16-9-13(15)10-17-14/h9-12H,5-8,15H2,1-4H3
InChIKeyWIOISGOAABPSQX-UHFFFAOYSA-N
XLogP2.96
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-N,2-N-bis(3-methylbutyl)pyrimidine-2,4-diamine
CID 107871752
2-N-(2-methylpropyl)-2-N-pentan-3-ylpyrimidine-2,5-diamine
CID 79483689
2-N-methyl-2-N-pentan-2-ylpyrimidine-2,5-diamine
CID 61145457
5-bromo-2-N,2-N-bis(3-methylbutyl)pyridine-2,3-diamine
CID 107869179
2-[(5-aminopyrimidin-2-yl)-methylamino]propan-1-ol
CID 104551057
6-[2-[bis(2-methylpropyl)amino]ethyl]pyridin-3-amine
CID 107340097
2-N-(cyclopropylmethyl)-2-N-propylpyrimidine-2,5-diamine
CID 61146606
5-(methylaminomethyl)-N,N-bis(3-methylbutyl)pyrazin-2-amine
CID 107871217
5-ethyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine
CID 107871762
3-bromo-2-N,2-N-bis(2-methylpropyl)pyridine-2,5-diamine
CID 79531788
4-methyl-3-N,3-N-bis(3-methylbutyl)benzene-1,3-diamine
CID 107869155
6-(3-methylbutyl)pyridin-3-amine
CID 82414791

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine?
The IUPAC name of 2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine (CID 114011099) is 2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine.
What is the SMILES notation for 2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine?
The canonical SMILES for 2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine is CC(C)CCN(CCC(C)C)c1ncc(N)cn1.
What is the InChIKey of 2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine?
The InChIKey is WIOISGOAABPSQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-11(2)5-7-18(8-6-12(3)4)14-16-9-13(15)10-17-14/h9-12H,5-8,15H2,1-4H3.
What are the key properties of 2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine?
2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine has a molecular weight of 250.39 g/mol, XLogP of 2.96, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-bis(3-methylbutyl)pyrimidine-2,5-diamine is sourced from PubChem (CID 114011099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).