6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine

C11H18N4 — CID 122281906

IUPAC6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine
SMILESCN(C)c1cc(NC2CCCC2)ncn1
InChIInChI=1S/C11H18N4/c1-15(2)11-7-10(12-8-13-11)14-9-5-3-4-6-9/h7-9H,3-6H2,1-2H3,(H,12,13,14)
InChIKeyZZCGAJNFRGUWML-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.90
Rot. Bonds3

About 6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine

6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine (PubChem CID 122281906) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine
PubChem CID122281906
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine
SMILESCN(C)c1cc(NC2CCCC2)ncn1
InChIInChI=1S/C11H18N4/c1-15(2)11-7-10(12-8-13-11)14-9-5-3-4-6-9/h7-9H,3-6H2,1-2H3,(H,12,13,14)
InChIKeyZZCGAJNFRGUWML-UHFFFAOYSA-N
XLogP1.90
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-N-[1-(cyclohexylmethyl)piperidin-3-yl]-4-N,4-N-dimethylpyrimidine-4,6-diamine
CID 171998123
6-N-cyclohexyl-4-N-cyclopropylpyrimidine-4,6-diamine
CID 112854680
4-N,4-N-dimethyl-6-N-[1-(1,3-oxazol-2-yl)piperidin-4-yl]pyrimidine-4,6-diamine
CID 126888667
1-(azepan-1-yl)-2-[4-[[6-(dimethylamino)pyrimidin-4-yl]amino]piperidin-1-yl]ethanone
CID 146079543
[4-[[6-(dimethylamino)pyrimidin-4-yl]amino]piperidin-1-yl]-(4-methylcyclohexyl)methanone
CID 126888429
6-N-[1-(benzenesulfonyl)piperidin-4-yl]-4-N,4-N-dimethylpyrimidine-4,6-diamine
CID 171689746
4-N,4-N-dimethyl-6-N-[1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)piperidin-4-yl]pyrimidine-4,6-diamine
CID 126888677
6-N-[1-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)piperidin-4-yl]-4-N,4-N-dimethylpyrimidine-4,6-diamine
CID 126888483
4-N,4-N-dimethyl-6-N-[1-(1,3,4-oxadiazol-2-ylmethyl)piperidin-4-yl]pyrimidine-4,6-diamine
CID 126888582
4-N,4-N-dimethyl-6-N-[1-[(5-methyl-1H-pyrazol-3-yl)methyl]piperidin-4-yl]pyrimidine-4,6-diamine
CID 126888630
N-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-4-yl]-6-methoxypyrimidin-4-amine
CID 126888085
6-N-cyclopropyl-4-N-methyl-4-N-[(3R)-piperidin-3-yl]pyrimidine-4,6-diamine
CID 96555845

Frequently Asked Questions

What is the IUPAC name of 6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine?
The IUPAC name of 6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine (CID 122281906) is 6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine.
What is the SMILES notation for 6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine?
The canonical SMILES for 6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine is CN(C)c1cc(NC2CCCC2)ncn1.
What is the InChIKey of 6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine?
The InChIKey is ZZCGAJNFRGUWML-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-15(2)11-7-10(12-8-13-11)14-9-5-3-4-6-9/h7-9H,3-6H2,1-2H3,(H,12,13,14).
What are the key properties of 6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine?
6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine has a molecular weight of 206.29 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine is sourced from PubChem (CID 122281906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).