N-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine

C16H27N5 — CID 80994713

IUPACN-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine
SMILESCc1c(NN)nc(C2CC2)nc1NCCC1CCCCC1
InChIInChI=1S/C16H27N5/c1-11-14(18-10-9-12-5-3-2-4-6-12)19-16(13-7-8-13)20-15(11)21-17/h12-13H,2-10,17H2,1H3,(H2,18,19,20,21)
InChIKeyDVFKTMNSIDDCBN-UHFFFAOYSA-N
MW289.43 g/mol
LogP3.33
Rot. Bonds6

About N-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine

N-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine (PubChem CID 80994713) has the molecular formula C16H27N5 and a molecular weight of 289.43 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine
PubChem CID80994713
Molecular FormulaC16H27N5
Molecular Weight289.43 g/mol
Exact Mass289.23
IUPAC NameN-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine
SMILESCc1c(NN)nc(C2CC2)nc1NCCC1CCCCC1
InChIInChI=1S/C16H27N5/c1-11-14(18-10-9-12-5-3-2-4-6-12)19-16(13-7-8-13)20-15(11)21-17/h12-13H,2-10,17H2,1H3,(H2,18,19,20,21)
InChIKeyDVFKTMNSIDDCBN-UHFFFAOYSA-N
XLogP3.33
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.43
LogP ≤ 53.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

2-cyclopropyl-6-hydrazinyl-5-methyl-N-propylpyrimidin-4-amine
CID 81000575
N-(3-cyclopentylpropyl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 114137258
2-cyclopropyl-6-hydrazinyl-5-methyl-N-octylpyrimidin-4-amine
CID 115565442
N-(2-butoxyethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine
CID 81007682
2-cyclopropyl-6-hydrazinyl-5-methyl-N-(3-methylsulfonylpropyl)pyrimidin-4-amine
CID 81006052
2-[(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-methylpropan-1-ol
CID 80995092
N-(3-cyclopentylpropyl)-6-hydrazinyl-5-methyl-2-propylpyrimidin-4-amine
CID 106012944
4-N-(2-cyclopentylethyl)-2,5-dimethyl-6-N-propylpyrimidine-4,6-diamine
CID 80790570
2-cyclopropyl-6-hydrazinyl-5-methyl-N-propan-2-ylpyrimidin-4-amine
CID 81000903
2-[(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-N-ethylethanesulfonamide
CID 106341084
4-N-(2-cyclohexylethyl)-2-ethyl-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80986153
2-cyclopropyl-6-hydrazinyl-5-methyl-N-(2-pyrazol-1-ylethyl)pyrimidin-4-amine
CID 80994731

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine?
The IUPAC name of N-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine (CID 80994713) is N-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine.
What is the SMILES notation for N-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine?
The canonical SMILES for N-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine is Cc1c(NN)nc(C2CC2)nc1NCCC1CCCCC1.
What is the InChIKey of N-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine?
The InChIKey is DVFKTMNSIDDCBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N5/c1-11-14(18-10-9-12-5-3-2-4-6-12)19-16(13-7-8-13)20-15(11)21-17/h12-13H,2-10,17H2,1H3,(H2,18,19,20,21).
What are the key properties of N-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine?
N-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine has a molecular weight of 289.43 g/mol, XLogP of 3.33, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine is sourced from PubChem (CID 80994713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).