N-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine

C11H15N5O — CID 80907427

IUPACN-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine
SMILESCc1cc(NC(C)c2ccco2)nc(NN)n1
InChIInChI=1S/C11H15N5O/c1-7-6-10(15-11(13-7)16-12)14-8(2)9-4-3-5-17-9/h3-6,8H,12H2,1-2H3,(H2,13,14,15,16)
InChIKeyQXPANLHAYWTIPZ-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.84
Rot. Bonds4

About N-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine

N-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine (PubChem CID 80907427) has the molecular formula C11H15N5O and a molecular weight of 233.27 g/mol. Its IUPAC name is N-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine
PubChem CID80907427
Molecular FormulaC11H15N5O
Molecular Weight233.27 g/mol
Exact Mass233.13
IUPAC NameN-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine
SMILESCc1cc(NC(C)c2ccco2)nc(NN)n1
InChIInChI=1S/C11H15N5O/c1-7-6-10(15-11(13-7)16-12)14-8(2)9-4-3-5-17-9/h3-6,8H,12H2,1-2H3,(H2,13,14,15,16)
InChIKeyQXPANLHAYWTIPZ-UHFFFAOYSA-N
XLogP1.84
TPSA89.00 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.84
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-[1-(furan-2-yl)ethyl]-4-methoxy-6-methylpyrimidin-2-amine
CID 112691697
N-[1-(furan-2-yl)ethyl]-6-hydrazinylpyrimidin-4-amine
CID 80907705
(2S)-2-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylbutan-1-ol
CID 80923311
N-[1-(furan-2-yl)ethyl]-6-methoxy-2-methylpyrimidin-4-amine
CID 66325662
5-chloro-N-[1-(furan-2-yl)ethyl]-2-hydrazinylpyrimidin-4-amine
CID 80907426
N-(dicyclopropylmethyl)-2-hydrazinyl-6-methylpyrimidin-4-amine
CID 80897563
2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine
CID 80803462
ethyl 2-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]propanoate
CID 80897570
2-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-N,N-dimethylpropanamide
CID 80897678
3-N-[1-(furan-2-yl)ethyl]benzene-1,3-diamine
CID 43535637
6-chloro-2-ethyl-N-[1-(furan-2-yl)ethyl]pyrimidin-4-amine
CID 80936336
2-tert-butyl-6-chloro-N-[1-(furan-2-yl)ethyl]pyrimidin-4-amine
CID 80953409

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine?
The IUPAC name of N-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine (CID 80907427) is N-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine.
What is the SMILES notation for N-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine?
The canonical SMILES for N-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine is Cc1cc(NC(C)c2ccco2)nc(NN)n1.
What is the InChIKey of N-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine?
The InChIKey is QXPANLHAYWTIPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-7-6-10(15-11(13-7)16-12)14-8(2)9-4-3-5-17-9/h3-6,8H,12H2,1-2H3,(H2,13,14,15,16).
What are the key properties of N-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine?
N-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine has a molecular weight of 233.27 g/mol, XLogP of 1.84, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)ethyl]-2-hydrazinyl-6-methylpyrimidin-4-amine is sourced from PubChem (CID 80907427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).