5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide

C15H27N5O — CID 115327342

IUPAC5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide
SMILESCC(C)CCCCNC(=O)c1nc(C(C)C)ncc1NN
InChIInChI=1S/C15H27N5O/c1-10(2)7-5-6-8-17-15(21)13-12(20-16)9-18-14(19-13)11(3)4/h9-11,20H,5-8,16H2,1-4H3,(H,17,21)
InChIKeyKUCUYBDEUXDYTQ-UHFFFAOYSA-N
MW293.41 g/mol
LogP2.44
Rot. Bonds8

About 5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide

5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide (PubChem CID 115327342) has the molecular formula C15H27N5O and a molecular weight of 293.41 g/mol. Its IUPAC name is 5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide
PubChem CID115327342
Molecular FormulaC15H27N5O
Molecular Weight293.41 g/mol
Exact Mass293.22
IUPAC Name5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide
SMILESCC(C)CCCCNC(=O)c1nc(C(C)C)ncc1NN
InChIInChI=1S/C15H27N5O/c1-10(2)7-5-6-8-17-15(21)13-12(20-16)9-18-14(19-13)11(3)4/h9-11,20H,5-8,16H2,1-4H3,(H,17,21)
InChIKeyKUCUYBDEUXDYTQ-UHFFFAOYSA-N
XLogP2.44
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 52.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(4-amino-4-oxobutyl)-5-hydrazinyl-2-propan-2-ylpyrimidine-4-carboxamide
CID 62236900
5-(methylamino)-N-(4-methylpentyl)-2-propan-2-ylpyrimidine-4-carboxamide
CID 63003869
5-hydrazinyl-N-(4-methylsulfanylbutyl)-2-propan-2-ylpyrimidine-4-carboxamide
CID 113488256
5-hydrazinyl-N-pentan-2-yl-2-propan-2-ylpyrimidine-4-carboxamide
CID 62233583
N-[2-(dimethylamino)-2-methylpropyl]-5-hydrazinyl-2-propan-2-ylpyrimidine-4-carboxamide
CID 62243518
N-[2-(ethylamino)-2-oxoethyl]-5-hydrazinyl-2-propan-2-ylpyrimidine-4-carboxamide
CID 62241398
N-(3-methylbutyl)-2-propan-2-yl-5-(propylamino)pyrimidine-4-carboxamide
CID 63499131
5-(methylamino)-2-propan-2-yl-N-(3-sulfamoylpropyl)pyrimidine-4-carboxamide
CID 62179987
5-hydrazinyl-N-[2-(1H-imidazol-5-yl)ethyl]-2-propan-2-ylpyrimidine-4-carboxamide
CID 65236423
5-(methylamino)-2-propan-2-yl-N-propylpyrimidine-4-carboxamide
CID 55042358
N-[1-(ethylamino)-1-oxopropan-2-yl]-5-hydrazinyl-2-propan-2-ylpyrimidine-4-carboxamide
CID 62241327
5-(methylamino)-2-propan-2-yl-N-(3-propoxypropyl)pyrimidine-4-carboxamide
CID 82940841

Frequently Asked Questions

What is the IUPAC name of 5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide?
The IUPAC name of 5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide (CID 115327342) is 5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide.
What is the SMILES notation for 5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide?
The canonical SMILES for 5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide is CC(C)CCCCNC(=O)c1nc(C(C)C)ncc1NN.
What is the InChIKey of 5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide?
The InChIKey is KUCUYBDEUXDYTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-10(2)7-5-6-8-17-15(21)13-12(20-16)9-18-14(19-13)11(3)4/h9-11,20H,5-8,16H2,1-4H3,(H,17,21).
What are the key properties of 5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide?
5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide has a molecular weight of 293.41 g/mol, XLogP of 2.44, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-N-(5-methylhexyl)-2-propan-2-ylpyrimidine-4-carboxamide is sourced from PubChem (CID 115327342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).