N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine

C13H23N5 — CID 80906264

IUPACN-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine
SMILESCCCc1c(NN)ncnc1N(C)C(C)C1CC1
InChIInChI=1S/C13H23N5/c1-4-5-11-12(17-14)15-8-16-13(11)18(3)9(2)10-6-7-10/h8-10H,4-7,14H2,1-3H3,(H,15,16,17)
InChIKeyDKKLYOWDPFKGIL-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.95
Rot. Bonds6

About N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine

N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine (PubChem CID 80906264) has the molecular formula C13H23N5 and a molecular weight of 249.36 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine
PubChem CID80906264
Molecular FormulaC13H23N5
Molecular Weight249.36 g/mol
Exact Mass249.20
IUPAC NameN-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine
SMILESCCCc1c(NN)ncnc1N(C)C(C)C1CC1
InChIInChI=1S/C13H23N5/c1-4-5-11-12(17-14)15-8-16-13(11)18(3)9(2)10-6-7-10/h8-10H,4-7,14H2,1-3H3,(H,15,16,17)
InChIKeyDKKLYOWDPFKGIL-UHFFFAOYSA-N
XLogP1.95
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.95
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-(1-cyclopropylethyl)-4-N-methyl-6-N,5-dipropylpyrimidine-4,6-diamine
CID 80792671
6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine
CID 80906528
N-(1-cyclopropylethyl)-6-hydrazinyl-N-(2-methoxyethyl)-5-propylpyrimidin-4-amine
CID 80900457
2-[(6-hydrazinyl-5-propylpyrimidin-4-yl)-methylamino]propan-1-ol
CID 104557148
6-chloro-N-(1-cyclopropylethyl)-N-methyl-5-propylpyrimidin-4-amine
CID 55230256
N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine
CID 80906631
6-hydrazinyl-N,N-dimethyl-5-propylpyrimidin-4-amine
CID 80932720
2-[cyclopentyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]ethanol
CID 80904987
6-hydrazinyl-N-methyl-N-(oxan-4-ylmethyl)-5-propylpyrimidin-4-amine
CID 80910226
4-N-butan-2-yl-6-N-ethyl-4-N-methyl-5-propylpyrimidine-4,6-diamine
CID 80775365
N-(1,1-dioxothiolan-3-yl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine
CID 80899134
3-[(6-hydrazinyl-5-propylpyrimidin-4-yl)-methylamino]propanenitrile
CID 80916482

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine?
The IUPAC name of N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine (CID 80906264) is N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine.
What is the SMILES notation for N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine?
The canonical SMILES for N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine is CCCc1c(NN)ncnc1N(C)C(C)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine?
The InChIKey is DKKLYOWDPFKGIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5/c1-4-5-11-12(17-14)15-8-16-13(11)18(3)9(2)10-6-7-10/h8-10H,4-7,14H2,1-3H3,(H,15,16,17).
What are the key properties of N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine?
N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine has a molecular weight of 249.36 g/mol, XLogP of 1.95, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine is sourced from PubChem (CID 80906264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).