N'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine

C10H16N4 — CID 117212308

IUPACN'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine
SMILESNCCNc1cnc(C2CCC2)nc1
InChIInChI=1S/C10H16N4/c11-4-5-12-9-6-13-10(14-7-9)8-2-1-3-8/h6-8,12H,1-5,11H2
InChIKeyXNAUWVRRMBKQFF-UHFFFAOYSA-N
MW192.27 g/mol
LogP1.11
Rot. Bonds4

About N'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine

N'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine (PubChem CID 117212308) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is N'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine
PubChem CID117212308
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC NameN'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine
SMILESNCCNc1cnc(C2CCC2)nc1
InChIInChI=1S/C10H16N4/c11-4-5-12-9-6-13-10(14-7-9)8-2-1-3-8/h6-8,12H,1-5,11H2
InChIKeyXNAUWVRRMBKQFF-UHFFFAOYSA-N
XLogP1.11
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N'-(4-cyclopentyl-2-cyclopropylpyrimidin-5-yl)ethane-1,2-diamine
CID 117211581
N'-(2-methylpyrimidin-5-yl)ethane-1,2-diamine
CID 84649652
N'-[2-cyclobutyl-4-(4-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine
CID 117211923
N'-[4-(2-chlorophenyl)-2-cyclobutylpyrimidin-5-yl]ethane-1,2-diamine
CID 117211824
N'-(2-cyclobutyl-4-cyclopropylpyrimidin-5-yl)propane-1,3-diamine
CID 117211459
(2-cyclooctylpyrimidin-5-yl)methanamine
CID 80610612
N'-(4-cyclohexylphenyl)ethane-1,2-diamine
CID 82493726
N'-[2-cyclopentyl-4-(2-methoxyphenyl)pyrimidin-5-yl]ethane-1,2-diamine
CID 117211831
N'-[2-cyclopentyl-4-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine
CID 117211827
N'-(2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)ethane-1,2-diamine
CID 117212057
2-(2-cyclopropylpyrimidin-5-yl)ethanamine
CID 62757903
2-cyclopentylpyrimidine-5-carbaldehyde
CID 58228458

Frequently Asked Questions

What is the IUPAC name of N'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine?
The IUPAC name of N'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine (CID 117212308) is N'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine.
What is the SMILES notation for N'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine?
The canonical SMILES for N'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine is NCCNc1cnc(C2CCC2)nc1.
What is the InChIKey of N'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine?
The InChIKey is XNAUWVRRMBKQFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c11-4-5-12-9-6-13-10(14-7-9)8-2-1-3-8/h6-8,12H,1-5,11H2.
What are the key properties of N'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine?
N'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine has a molecular weight of 192.27 g/mol, XLogP of 1.11, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine is sourced from PubChem (CID 117212308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).