N-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine

C12H21N5 — CID 80911322

IUPACN-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
SMILESCc1nc(NN)c(C)c(NC(C)CC2CC2)n1
InChIInChI=1S/C12H21N5/c1-7(6-10-4-5-10)14-11-8(2)12(17-13)16-9(3)15-11/h7,10H,4-6,13H2,1-3H3,(H2,14,15,16,17)
InChIKeyHDRLILPHIRCDRO-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.98
Rot. Bonds5

About N-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine

N-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine (PubChem CID 80911322) has the molecular formula C12H21N5 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
PubChem CID80911322
Molecular FormulaC12H21N5
Molecular Weight235.33 g/mol
Exact Mass235.18
IUPAC NameN-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
SMILESCc1nc(NN)c(C)c(NC(C)CC2CC2)n1
InChIInChI=1S/C12H21N5/c1-7(6-10-4-5-10)14-11-8(2)12(17-13)16-9(3)15-11/h7,10H,4-6,13H2,1-3H3,(H2,14,15,16,17)
InChIKeyHDRLILPHIRCDRO-UHFFFAOYSA-N
XLogP1.98
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.98
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

4-N-(1-cyclopropylpropan-2-yl)-6-N-ethyl-2,5-dimethylpyrimidine-4,6-diamine
CID 80838415
N-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 80911806
3-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]butan-1-ol
CID 83180147
6-hydrazinyl-2,5-dimethyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine
CID 80897399
N-(1-ethoxypropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 80903132
4-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]pentan-1-ol
CID 80926849
6-hydrazinyl-2,5-dimethyl-N-octan-2-ylpyrimidin-4-amine
CID 80897483
2-tert-butyl-4-N-(1-cyclopropylpropan-2-yl)-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 80985371
2-cyclopropyl-6-hydrazinyl-5-methyl-N-propan-2-ylpyrimidin-4-amine
CID 81000903
N-(cyclopropylmethyl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 81001481
N-cyclopentyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 80932373
2-[(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)amino]propan-1-ol
CID 80995792

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine?
The IUPAC name of N-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine (CID 80911322) is N-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for N-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine?
The canonical SMILES for N-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine is Cc1nc(NN)c(C)c(NC(C)CC2CC2)n1.
What is the InChIKey of N-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine?
The InChIKey is HDRLILPHIRCDRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5/c1-7(6-10-4-5-10)14-11-8(2)12(17-13)16-9(3)15-11/h7,10H,4-6,13H2,1-3H3,(H2,14,15,16,17).
What are the key properties of N-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine?
N-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine has a molecular weight of 235.33 g/mol, XLogP of 1.98, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 80911322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).