6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine

C15H29N5 — CID 115565446

IUPAC6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine
SMILESCCCCCCCCNc1cc(NN)nc(CCC)n1
InChIInChI=1S/C15H29N5/c1-3-5-6-7-8-9-11-17-14-12-15(20-16)19-13(18-14)10-4-2/h12H,3-11,16H2,1-2H3,(H2,17,18,19,20)
InChIKeyWAJCDHXUPJUABO-UHFFFAOYSA-N
MW279.43 g/mol
LogP3.49
Rot. Bonds11

About 6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine

6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine (PubChem CID 115565446) has the molecular formula C15H29N5 and a molecular weight of 279.43 g/mol. Its IUPAC name is 6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine
PubChem CID115565446
Molecular FormulaC15H29N5
Molecular Weight279.43 g/mol
Exact Mass279.24
IUPAC Name6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine
SMILESCCCCCCCCNc1cc(NN)nc(CCC)n1
InChIInChI=1S/C15H29N5/c1-3-5-6-7-8-9-11-17-14-12-15(20-16)19-13(18-14)10-4-2/h12H,3-11,16H2,1-2H3,(H2,17,18,19,20)
InChIKeyWAJCDHXUPJUABO-UHFFFAOYSA-N
XLogP3.49
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 53.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-N-decyl-2-propylpyrimidine-4,6-diamine
CID 80943780
6-hydrazinyl-2-methyl-N-pentylpyrimidin-4-amine
CID 80932312
4-N-butyl-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80946225
5-[(6-hydrazinyl-2-propylpyrimidin-4-yl)amino]-2-methylpentan-1-ol
CID 114152330
N-(6-hydrazinyl-2-propylpyrimidin-4-yl)-N'-methyl-N'-propan-2-ylpropane-1,3-diamine
CID 106043629
ethyl 4-[(6-hydrazinyl-2-propylpyrimidin-4-yl)amino]butanoate
CID 80946727
6-butoxy-N-hexyl-2-propylpyrimidin-4-amine
CID 82454392
2-cyclopropyl-6-hydrazinyl-N-pentylpyrimidin-4-amine
CID 80968524
2-heptyl-6-methyl-N-octylpyrimidin-4-amine
CID 58693161
N-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720771
6-hydrazinyl-N-(2-imidazol-1-ylethyl)-2-propylpyrimidin-4-amine
CID 80947963
2-ethyl-4-N-octylpyrimidine-4,6-diamine
CID 113336788

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine (CID 115565446) is 6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine is CCCCCCCCNc1cc(NN)nc(CCC)n1.
What is the InChIKey of 6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine?
The InChIKey is WAJCDHXUPJUABO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N5/c1-3-5-6-7-8-9-11-17-14-12-15(20-16)19-13(18-14)10-4-2/h12H,3-11,16H2,1-2H3,(H2,17,18,19,20).
What are the key properties of 6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine?
6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine has a molecular weight of 279.43 g/mol, XLogP of 3.49, 11 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine is sourced from PubChem (CID 115565446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).