N'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine

C13H24N6 — CID 80914205

IUPACN'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine
SMILESCc1cnc(NN)nc1NCCN(C)C1CCCC1
InChIInChI=1S/C13H24N6/c1-10-9-16-13(18-14)17-12(10)15-7-8-19(2)11-5-3-4-6-11/h9,11H,3-8,14H2,1-2H3,(H2,15,16,17,18)
InChIKeyAOVABXQXHGUECR-UHFFFAOYSA-N
MW264.38 g/mol
LogP1.36
Rot. Bonds6

About N'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine

N'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine (PubChem CID 80914205) has the molecular formula C13H24N6 and a molecular weight of 264.38 g/mol. Its IUPAC name is N'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine
PubChem CID80914205
Molecular FormulaC13H24N6
Molecular Weight264.38 g/mol
Exact Mass264.21
IUPAC NameN'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine
SMILESCc1cnc(NN)nc1NCCN(C)C1CCCC1
InChIInChI=1S/C13H24N6/c1-10-9-16-13(18-14)17-12(10)15-7-8-19(2)11-5-3-4-6-11/h9,11H,3-8,14H2,1-2H3,(H2,15,16,17,18)
InChIKeyAOVABXQXHGUECR-UHFFFAOYSA-N
XLogP1.36
TPSA79.10 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.38
LogP ≤ 51.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-cyclopentyl-N-(5-fluoro-2-hydrazinylpyrimidin-4-yl)-N'-methylethane-1,2-diamine
CID 80914834
N'-cyclopentyl-N-(3,6-dimethylpyrazin-2-yl)-N'-methylethane-1,2-diamine
CID 65417550
N'-cyclopentyl-N-(5-fluoropyrimidin-2-yl)-N'-methylethane-1,2-diamine
CID 112703177
N'-cyclopentyl-N'-methyl-N-(3-methylquinoxalin-2-yl)ethane-1,2-diamine
CID 63318491
N'-cyclopentyl-N-(6-hydrazinylpyrazin-2-yl)-N'-methylethane-1,2-diamine
CID 80914281
3-[(2-hydrazinyl-5-methylpyrimidin-4-yl)amino]propan-1-ol
CID 80942779
2-hydrazinyl-N-(2-methoxyethyl)-5-methylpyrimidin-4-amine
CID 80932366
2-hydrazinyl-5-methyl-N-(2-phenylethyl)pyrimidin-4-amine
CID 80944185
5-chloro-4-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-N-methylpyrimidine-2,4-diamine
CID 80822914
2-hydrazinyl-5-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-4-amine
CID 80899340
2-[2-[cyclopentyl(methyl)amino]ethylamino]-4-methylpyrimidine-5-carboxylic acid
CID 83181981
4-N-[2-[cyclopentyl(methyl)amino]ethyl]-5-ethylpyrimidine-4,6-diamine
CID 80829852

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine?
The IUPAC name of N'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine (CID 80914205) is N'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine.
What is the SMILES notation for N'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine?
The canonical SMILES for N'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine is Cc1cnc(NN)nc1NCCN(C)C1CCCC1.
What is the InChIKey of N'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine?
The InChIKey is AOVABXQXHGUECR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N6/c1-10-9-16-13(18-14)17-12(10)15-7-8-19(2)11-5-3-4-6-11/h9,11H,3-8,14H2,1-2H3,(H2,15,16,17,18).
What are the key properties of N'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine?
N'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine has a molecular weight of 264.38 g/mol, XLogP of 1.36, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methylethane-1,2-diamine is sourced from PubChem (CID 80914205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).