N-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine

C16H29N5 — CID 80968904

IUPACN-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine
SMILESCC(C)CN(c1cc(NN)nc(C(C)C)n1)C1CCCC1
InChIInChI=1S/C16H29N5/c1-11(2)10-21(13-7-5-6-8-13)15-9-14(20-17)18-16(19-15)12(3)4/h9,11-13H,5-8,10,17H2,1-4H3,(H,18,19,20)
InChIKeyHFDVBDADLRZZKB-UHFFFAOYSA-N
MW291.44 g/mol
LogP3.29
Rot. Bonds6

About N-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine

N-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine (PubChem CID 80968904) has the molecular formula C16H29N5 and a molecular weight of 291.44 g/mol. Its IUPAC name is N-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine
PubChem CID80968904
Molecular FormulaC16H29N5
Molecular Weight291.44 g/mol
Exact Mass291.24
IUPAC NameN-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine
SMILESCC(C)CN(c1cc(NN)nc(C(C)C)n1)C1CCCC1
InChIInChI=1S/C16H29N5/c1-11(2)10-21(13-7-5-6-8-13)15-9-14(20-17)18-16(19-15)12(3)4/h9,11-13H,5-8,10,17H2,1-4H3,(H,18,19,20)
InChIKeyHFDVBDADLRZZKB-UHFFFAOYSA-N
XLogP3.29
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 53.29
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

N-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80968637
4-N-cyclopentyl-4-N-(2-methylpropyl)pyrimidine-2,4,6-triamine
CID 80855037
4-N-cyclopentyl-4-N-(3-methylbutyl)-2-propan-2-ylpyrimidine-4,6-diamine
CID 80960192
2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol
CID 102640233
6-hydrazinyl-N-(2-methylpropyl)-N-pentan-3-yl-2-propan-2-ylpyrimidin-4-amine
CID 80968795
N-(4,4-dimethylcyclohexyl)-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80968908
4-N-cyclopropyl-4-N-ethyl-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 80967655
4-N-cyclopropyl-6-N-methyl-2-propan-2-yl-4-N-propylpyrimidine-4,6-diamine
CID 80967223
4-N-cycloheptyl-6-hydrazinyl-4-N-methylpyrimidine-2,4-diamine
CID 80899128
N-cyclooctyl-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80968823
N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 105421058
N-cyclopropyl-2-hydrazinyl-N-(2-methylpropyl)-6-(trifluoromethyl)pyrimidin-4-amine
CID 114567101

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of N-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine (CID 80968904) is N-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for N-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine is CC(C)CN(c1cc(NN)nc(C(C)C)n1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is HFDVBDADLRZZKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N5/c1-11(2)10-21(13-7-5-6-8-13)15-9-14(20-17)18-16(19-15)12(3)4/h9,11-13H,5-8,10,17H2,1-4H3,(H,18,19,20).
What are the key properties of N-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine?
N-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 291.44 g/mol, XLogP of 3.29, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 80968904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).