2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine

C15H28N4 — CID 106142913

IUPAC2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine
SMILESCc1cc(C(C)C)nc(NCC(C)(C)CCCN)n1
InChIInChI=1S/C15H28N4/c1-11(2)13-9-12(3)18-14(19-13)17-10-15(4,5)7-6-8-16/h9,11H,6-8,10,16H2,1-5H3,(H,17,18,19)
InChIKeyZNUIDGYVBNXIJQ-UHFFFAOYSA-N
MW264.42 g/mol
LogP3.09
Rot. Bonds7

About 2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine

2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine (PubChem CID 106142913) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine.

Molecular Properties

Compound Name2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine
PubChem CID106142913
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine
SMILESCc1cc(C(C)C)nc(NCC(C)(C)CCCN)n1
InChIInChI=1S/C15H28N4/c1-11(2)13-9-12(3)18-14(19-13)17-10-15(4,5)7-6-8-16/h9,11H,6-8,10,16H2,1-5H3,(H,17,18,19)
InChIKeyZNUIDGYVBNXIJQ-UHFFFAOYSA-N
XLogP3.09
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,2-dimethoxyethyl)-4-methyl-6-propan-2-ylpyrimidin-2-amine
CID 107390199
N-cyclopropyl-N'-(4-methyl-6-propan-2-ylpyrimidin-2-yl)ethane-1,2-diamine
CID 113491544
N-[2-(2-methoxyethoxy)ethyl]-4-methyl-6-propan-2-ylpyrimidin-2-amine
CID 113491491
N'-methyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)-N'-propan-2-ylethane-1,2-diamine
CID 113491499
N-[(3-aminocyclopentyl)methyl]-4-methyl-6-propan-2-ylpyrimidin-2-amine
CID 106127087
4,4-dimethyl-2-[[(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]methyl]pentanoic acid
CID 107475049
4-[(5-amino-2,2-dimethylpentyl)amino]-2-propan-2-yl-1H-pyrimidin-6-one
CID 136857346
N-(5-bromopyrimidin-2-yl)-2,2-dimethylpentane-1,5-diamine
CID 106142919
N-(5-fluoropyrimidin-2-yl)-2,2-dimethylpentane-1,5-diamine
CID 106142510
2-N-(4,6-dimethylpyrimidin-2-yl)propane-1,2-diamine
CID 63732356
2-(2,2-dimethylheptylamino)-6-methylpyrimidine-4-carbonitrile
CID 107544876
4-methyl-N-[(3-methyl-4-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine
CID 114701017

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine?
The IUPAC name of 2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine (CID 106142913) is 2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine.
What is the SMILES notation for 2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine?
The canonical SMILES for 2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine is Cc1cc(C(C)C)nc(NCC(C)(C)CCCN)n1.
What is the InChIKey of 2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine?
The InChIKey is ZNUIDGYVBNXIJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-11(2)13-9-12(3)18-14(19-13)17-10-15(4,5)7-6-8-16/h9,11H,6-8,10,16H2,1-5H3,(H,17,18,19).
What are the key properties of 2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine?
2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine has a molecular weight of 264.42 g/mol, XLogP of 3.09, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pentane-1,5-diamine is sourced from PubChem (CID 106142913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).