6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine

C11H20N6 — CID 107416016

IUPAC6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine
SMILESCC1CCC(CNc2cc(NN)nc(N)n2)C1
InChIInChI=1S/C11H20N6/c1-7-2-3-8(4-7)6-14-9-5-10(17-13)16-11(12)15-9/h5,7-8H,2-4,6,13H2,1H3,(H4,12,14,15,16,17)
InChIKeyFQKVIBAGAMPAHO-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.19
Rot. Bonds4

About 6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine

6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine (PubChem CID 107416016) has the molecular formula C11H20N6 and a molecular weight of 236.32 g/mol. Its IUPAC name is 6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine
PubChem CID107416016
Molecular FormulaC11H20N6
Molecular Weight236.32 g/mol
Exact Mass236.17
IUPAC Name6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine
SMILESCC1CCC(CNc2cc(NN)nc(N)n2)C1
InChIInChI=1S/C11H20N6/c1-7-2-3-8(4-7)6-14-9-5-10(17-13)16-11(12)15-9/h5,7-8H,2-4,6,13H2,1H3,(H4,12,14,15,16,17)
InChIKeyFQKVIBAGAMPAHO-UHFFFAOYSA-N
XLogP1.19
TPSA101.88 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.19
H-Bond Donors ≤ 54
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

6-hydrazinyl-N-[(3-methylcyclopentyl)methyl]-2-methylsulfanylpyrimidin-4-amine
CID 107416021
6-methyl-4-N-[(4-methylcyclohexyl)methyl]pyrimidine-2,4-diamine
CID 78969897
2-cyclopropyl-6-N-ethyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-4,6-diamine
CID 107415826
4-N-[(1,1-dioxothiolan-3-yl)methyl]-6-hydrazinylpyrimidine-2,4-diamine
CID 80908722
4-N-[(3-methylcyclopentyl)methyl]-2-propylpyrimidine-4,6-diamine
CID 107415976
6-N-[(3-methylcyclopentyl)methyl]-4-(trifluoromethyl)pyridine-2,6-diamine
CID 107415860
3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine
CID 107415795
3-[[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 106138702
4-[[[2-amino-6-(propylamino)pyrimidin-4-yl]amino]methyl]cyclohexan-1-ol
CID 106138505
4-N-(2-bicyclo[2.2.1]heptanylmethyl)-6-hydrazinylpyrimidine-2,4-diamine
CID 80910192
3-[[(6-hydrazinyl-2-methylsulfanylpyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 106138701
4-N-(cyclopropylmethyl)-6-N-[2-(dimethylamino)ethyl]pyrimidine-2,4,6-triamine
CID 90909451

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine?
The IUPAC name of 6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine (CID 107416016) is 6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine.
What is the SMILES notation for 6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine?
The canonical SMILES for 6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine is CC1CCC(CNc2cc(NN)nc(N)n2)C1.
What is the InChIKey of 6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine?
The InChIKey is FQKVIBAGAMPAHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6/c1-7-2-3-8(4-7)6-14-9-5-10(17-13)16-11(12)15-9/h5,7-8H,2-4,6,13H2,1H3,(H4,12,14,15,16,17).
What are the key properties of 6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine?
6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine has a molecular weight of 236.32 g/mol, XLogP of 1.19, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine is sourced from PubChem (CID 107416016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).