N-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine

C15H27N5O — CID 83036694

IUPACN-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCc1c(NN)nc(C(C)C)nc1NC1CCOC(C)(C)C1
InChIInChI=1S/C15H27N5O/c1-9(2)12-18-13(10(3)14(19-12)20-16)17-11-6-7-21-15(4,5)8-11/h9,11H,6-8,16H2,1-5H3,(H2,17,18,19,20)
InChIKeyYJXTUXAXBFYMPO-UHFFFAOYSA-N
MW293.42 g/mol
LogP2.56
Rot. Bonds4

About N-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine

N-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine (PubChem CID 83036694) has the molecular formula C15H27N5O and a molecular weight of 293.42 g/mol. Its IUPAC name is N-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
PubChem CID83036694
Molecular FormulaC15H27N5O
Molecular Weight293.42 g/mol
Exact Mass293.22
IUPAC NameN-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCc1c(NN)nc(C(C)C)nc1NC1CCOC(C)(C)C1
InChIInChI=1S/C15H27N5O/c1-9(2)12-18-13(10(3)14(19-12)20-16)17-11-6-7-21-15(4,5)8-11/h9,11H,6-8,16H2,1-5H3,(H2,17,18,19,20)
InChIKeyYJXTUXAXBFYMPO-UHFFFAOYSA-N
XLogP2.56
TPSA85.09 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.42
LogP ≤ 52.56
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-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 81001479
4-N-(2,2-dimethyloxan-4-yl)-2-propan-2-ylpyrimidine-4,6-diamine
CID 83040002
6-hydrazinyl-5-methyl-2-propan-2-yl-N-(thiolan-3-yl)pyrimidin-4-amine
CID 103065385
3-chloro-N-(2,2-dimethyloxan-4-yl)-5,6-dimethylpyrazin-2-amine
CID 83029129
2-[(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)amino]cyclohexan-1-ol
CID 81006891
2-[(2,2-dimethyloxan-4-yl)amino]-6-methylpyridine-3-carbothioamide
CID 83029228
4-N-(2,2-dimethyloxan-4-yl)-6-hydrazinylpyrimidine-2,4-diamine
CID 83039065
N-(cyclopropylmethyl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 81001481
2-N-(2,2-dimethyloxan-4-yl)-4-methylpyridine-2,3-diamine
CID 83027817
2-N-(2,2-dimethyloxan-4-yl)-5-methylpyridine-2,3-diamine
CID 83027015
2-N-(2,2-dimethyloxan-4-yl)pyrazine-2,5-diamine
CID 83040320
N-(2,2-dimethyloxan-4-yl)-2-methyl-5,6,7,8-tetrahydroquinazolin-4-amine
CID 133462048

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of N-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine (CID 83036694) is N-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for N-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine is Cc1c(NN)nc(C(C)C)nc1NC1CCOC(C)(C)C1.
What is the InChIKey of N-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is YJXTUXAXBFYMPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-9(2)12-18-13(10(3)14(19-12)20-16)17-11-6-7-21-15(4,5)8-11/h9,11H,6-8,16H2,1-5H3,(H2,17,18,19,20).
What are the key properties of N-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine?
N-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 293.42 g/mol, XLogP of 2.56, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyloxan-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 83036694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).