6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine

C13H21N7 — CID 80908147

IUPAC6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine
SMILESCCCc1c(NN)ncnc1NCCc1nccn1C
InChIInChI=1S/C13H21N7/c1-3-4-10-12(17-9-18-13(10)19-14)16-6-5-11-15-7-8-20(11)2/h7-9H,3-6,14H2,1-2H3,(H2,16,17,18,19)
InChIKeyCKDHAOMZDQGVLQ-UHFFFAOYSA-N
MW275.36 g/mol
LogP1.10
Rot. Bonds7

About 6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine

6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine (PubChem CID 80908147) has the molecular formula C13H21N7 and a molecular weight of 275.36 g/mol. Its IUPAC name is 6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine
PubChem CID80908147
Molecular FormulaC13H21N7
Molecular Weight275.36 g/mol
Exact Mass275.19
IUPAC Name6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine
SMILESCCCc1c(NN)ncnc1NCCc1nccn1C
InChIInChI=1S/C13H21N7/c1-3-4-10-12(17-9-18-13(10)19-14)16-6-5-11-15-7-8-20(11)2/h7-9H,3-6,14H2,1-2H3,(H2,16,17,18,19)
InChIKeyCKDHAOMZDQGVLQ-UHFFFAOYSA-N
XLogP1.10
TPSA93.68 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 51.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine with MolForge

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Related Compounds

methanamine;1-methyl-2-propylimidazole
CID 164902083
5-fluoro-6-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]pyrimidin-4-amine
CID 103644661
N-[2-(1-methylimidazol-2-yl)ethyl]-6-propylpyrimidin-4-amine
CID 61242268
2-[(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]ethanesulfonamide
CID 80906224
6-hydrazinyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-5-propylpyrimidin-4-amine
CID 106412478
N-[2-(4-fluorophenyl)ethyl]-6-hydrazinyl-5-propylpyrimidin-4-amine
CID 80911399
5-ethyl-6-hydrazinyl-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 80914072
3-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]pentan-3-amine
CID 106328740
azane;1-methyl-2-propylimidazole
CID 174525892
N-[2-(1-methylimidazol-2-yl)ethyl]propan-1-amine
CID 61214414
1-methyl-3-N-[2-(1-methylimidazol-2-yl)ethyl]pyrazole-3,4-diamine
CID 103078356
6-N-methyl-4-N-[2-(1-methylimidazol-2-yl)ethyl]-5-nitropyrimidine-4,6-diamine
CID 78955451

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine (CID 80908147) is 6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine is CCCc1c(NN)ncnc1NCCc1nccn1C.
What is the InChIKey of 6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine?
The InChIKey is CKDHAOMZDQGVLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N7/c1-3-4-10-12(17-9-18-13(10)19-14)16-6-5-11-15-7-8-20(11)2/h7-9H,3-6,14H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine?
6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine has a molecular weight of 275.36 g/mol, XLogP of 1.10, 7 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine is sourced from PubChem (CID 80908147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).