N-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine

C16H23N5 — CID 115916099

IUPACN-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine
SMILESCCN(CC(C)C)c1cc(NN)nc(-c2ccccc2)n1
InChIInChI=1S/C16H23N5/c1-4-21(11-12(2)3)15-10-14(20-17)18-16(19-15)13-8-6-5-7-9-13/h5-10,12H,4,11,17H2,1-3H3,(H,18,19,20)
InChIKeyAVFHGPNVXJNWEL-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.91
Rot. Bonds6

About N-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine

N-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine (PubChem CID 115916099) has the molecular formula C16H23N5 and a molecular weight of 285.39 g/mol. Its IUPAC name is N-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine
PubChem CID115916099
Molecular FormulaC16H23N5
Molecular Weight285.39 g/mol
Exact Mass285.20
IUPAC NameN-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine
SMILESCCN(CC(C)C)c1cc(NN)nc(-c2ccccc2)n1
InChIInChI=1S/C16H23N5/c1-4-21(11-12(2)3)15-10-14(20-17)18-16(19-15)13-8-6-5-7-9-13/h5-10,12H,4,11,17H2,1-3H3,(H,18,19,20)
InChIKeyAVFHGPNVXJNWEL-UHFFFAOYSA-N
XLogP2.91
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.91
H-Bond Donors ≤ 52
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,4-N-diethyl-6-N-(2-methylpropyl)-2-phenylpyrimidine-4,6-diamine
CID 112879814
(6-ethyl-2-phenylpyrimidin-4-yl)hydrazine
CID 62252566
4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine
CID 112879230
6-hydrazinyl-N-(4-methylpentyl)-2-phenylpyrimidin-4-amine
CID 115916187
N,N-diethyl-2,6-diphenylpyrimidin-4-amine
CID 2057498
6-hydrazinyl-N-(3-methylpentan-2-yl)-2-phenylpyrimidin-4-amine
CID 115916157
6-N-[4-(dimethylamino)phenyl]-4-N,4-N-diethyl-2-phenylpyrimidine-4,6-diamine
CID 112881588
(2-phenyl-6-propylpyrimidin-4-yl)hydrazine
CID 62252370
6-hydrazinyl-N-(2-methyl-3-methylsulfanylpropyl)-2-phenylpyrimidin-4-amine
CID 115916202
N-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide
CID 112881584
6-chloro-N,N-diethyl-2-phenylpyrimidin-4-amine
CID 796090
N,N-diethyl-4-hydrazinyl-6-phenylpyrimidin-2-amine
CID 62251410

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine?
The IUPAC name of N-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine (CID 115916099) is N-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine.
What is the SMILES notation for N-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine?
The canonical SMILES for N-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine is CCN(CC(C)C)c1cc(NN)nc(-c2ccccc2)n1.
What is the InChIKey of N-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine?
The InChIKey is AVFHGPNVXJNWEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5/c1-4-21(11-12(2)3)15-10-14(20-17)18-16(19-15)13-8-6-5-7-9-13/h5-10,12H,4,11,17H2,1-3H3,(H,18,19,20).
What are the key properties of N-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine?
N-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine has a molecular weight of 285.39 g/mol, XLogP of 2.91, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine is sourced from PubChem (CID 115916099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).