N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine

C14H26N6 — CID 114506749

IUPACN-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1c(NN)ncnc1NC1CCN(C)CC1C
InChIInChI=1S/C14H26N6/c1-9(2)12-13(16-8-17-14(12)19-15)18-11-5-6-20(4)7-10(11)3/h8-11H,5-7,15H2,1-4H3,(H2,16,17,18,19)
InChIKeyPQYQFTMFPMBYCY-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.64
Rot. Bonds4

About N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine

N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine (PubChem CID 114506749) has the molecular formula C14H26N6 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine
PubChem CID114506749
Molecular FormulaC14H26N6
Molecular Weight278.40 g/mol
Exact Mass278.22
IUPAC NameN-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1c(NN)ncnc1NC1CCN(C)CC1C
InChIInChI=1S/C14H26N6/c1-9(2)12-13(16-8-17-14(12)19-15)18-11-5-6-20(4)7-10(11)3/h8-11H,5-7,15H2,1-4H3,(H2,16,17,18,19)
InChIKeyPQYQFTMFPMBYCY-UHFFFAOYSA-N
XLogP1.64
TPSA79.10 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.64
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

6-hydrazinyl-N-[(1-methylpiperidin-4-yl)methyl]-5-propan-2-ylpyrimidin-4-amine
CID 80902596
N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 114506710
4-N-(1,3-dimethylpiperidin-4-yl)-5-ethylpyrimidine-4,6-diamine
CID 114506491
4-N-(1,3-dimethylpiperidin-4-yl)-5-propylpyrimidine-4,6-diamine
CID 114506446
N-(1,3-dimethylpiperidin-4-yl)-5-iodopyrimidin-4-amine
CID 114504858
6-hydrazinyl-N-(7-oxabicyclo[2.2.1]heptan-2-yl)-5-propan-2-ylpyrimidin-4-amine
CID 80926873
3-[(1,3-dimethylpiperidin-4-yl)amino]-1-propan-2-ylpyrazin-2-one
CID 114504666
4-N-(1,3-dimethylpiperidin-4-yl)-5-methyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 114506658
6-hydrazinyl-N-methyl-N-(1-methylpiperidin-3-yl)-5-propan-2-ylpyrimidin-4-amine
CID 80919618
N-(2,2-dimethylcyclopropyl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine
CID 80908900
6-hydrazinyl-N-[(1-methylpyrrolidin-2-yl)methyl]-5-propan-2-ylpyrimidin-4-amine
CID 114138405
N-(1,3-dimethylpiperidin-4-yl)-2-hydrazinylpyridin-4-amine
CID 114506746

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine?
The IUPAC name of N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine (CID 114506749) is N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine is CC(C)c1c(NN)ncnc1NC1CCN(C)CC1C.
What is the InChIKey of N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine?
The InChIKey is PQYQFTMFPMBYCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N6/c1-9(2)12-13(16-8-17-14(12)19-15)18-11-5-6-20(4)7-10(11)3/h8-11H,5-7,15H2,1-4H3,(H2,16,17,18,19).
What are the key properties of N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine?
N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine has a molecular weight of 278.40 g/mol, XLogP of 1.64, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 114506749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).