N-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine

C13H23N5 — CID 80911806

IUPACN-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
SMILESCCC(CC1CC1)Nc1nc(C)nc(NN)c1C
InChIInChI=1S/C13H23N5/c1-4-11(7-10-5-6-10)17-12-8(2)13(18-14)16-9(3)15-12/h10-11H,4-7,14H2,1-3H3,(H2,15,16,17,18)
InChIKeyIGZSURPJFIRKAW-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.37
Rot. Bonds6

About N-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine

N-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine (PubChem CID 80911806) has the molecular formula C13H23N5 and a molecular weight of 249.36 g/mol. Its IUPAC name is N-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
PubChem CID80911806
Molecular FormulaC13H23N5
Molecular Weight249.36 g/mol
Exact Mass249.20
IUPAC NameN-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
SMILESCCC(CC1CC1)Nc1nc(C)nc(NN)c1C
InChIInChI=1S/C13H23N5/c1-4-11(7-10-5-6-10)17-12-8(2)13(18-14)16-9(3)15-12/h10-11H,4-7,14H2,1-3H3,(H2,15,16,17,18)
InChIKeyIGZSURPJFIRKAW-UHFFFAOYSA-N
XLogP2.37
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.37
H-Bond Donors ≤ 53
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-(1-cyclopropylpropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 80911322
6-hydrazinyl-N-(1-methoxybutan-2-yl)-2,5-dimethylpyrimidin-4-amine
CID 80918272
6-hydrazinyl-N-(1-methoxypentan-2-yl)-2,5-dimethylpyrimidin-4-amine
CID 80918200
4-N-(1-cyclopropylpropan-2-yl)-6-N-ethyl-2,5-dimethylpyrimidine-4,6-diamine
CID 80838415
2-tert-butyl-N-hexan-3-yl-6-hydrazinyl-5-methylpyrimidin-4-amine
CID 81006064
2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-3-methoxypropan-1-ol
CID 106198990
6-chloro-2-N-(1-cyclopropylbutan-2-yl)pyridine-2,3-diamine
CID 115474196
3-(1-cyclopropylbutan-2-ylamino)-5,6-dimethylpyridazine-4-carboxylic acid
CID 63996008
6-hydrazinyl-2,5-dimethyl-N-(2-methylbutyl)pyrimidin-4-amine
CID 80918838
N-(1-ethoxypropan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 80903132
N-cyclopentyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 80932373
6-hydrazinyl-2,5-dimethyl-N-octan-2-ylpyrimidin-4-amine
CID 80897483

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine?
The IUPAC name of N-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine (CID 80911806) is N-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for N-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine?
The canonical SMILES for N-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine is CCC(CC1CC1)Nc1nc(C)nc(NN)c1C.
What is the InChIKey of N-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine?
The InChIKey is IGZSURPJFIRKAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5/c1-4-11(7-10-5-6-10)17-12-8(2)13(18-14)16-9(3)15-12/h10-11H,4-7,14H2,1-3H3,(H2,15,16,17,18).
What are the key properties of N-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine?
N-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine has a molecular weight of 249.36 g/mol, XLogP of 2.37, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylbutan-2-yl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 80911806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).