N-nonan-2-yl-1-propan-2-ylpyrazol-4-amine

C15H29N3 — CID 63478238

IUPACN-nonan-2-yl-1-propan-2-ylpyrazol-4-amine
SMILESCCCCCCCC(C)Nc1cnn(C(C)C)c1
InChIInChI=1S/C15H29N3/c1-5-6-7-8-9-10-14(4)17-15-11-16-18(12-15)13(2)3/h11-14,17H,5-10H2,1-4H3
InChIKeyUGBNGIZKIXALSD-UHFFFAOYSA-N
MW251.42 g/mol
LogP4.62
Rot. Bonds9

About N-nonan-2-yl-1-propan-2-ylpyrazol-4-amine

N-nonan-2-yl-1-propan-2-ylpyrazol-4-amine (PubChem CID 63478238) has the molecular formula C15H29N3 and a molecular weight of 251.42 g/mol. Its IUPAC name is N-nonan-2-yl-1-propan-2-ylpyrazol-4-amine.

Molecular Properties

Compound NameN-nonan-2-yl-1-propan-2-ylpyrazol-4-amine
PubChem CID63478238
Molecular FormulaC15H29N3
Molecular Weight251.42 g/mol
Exact Mass251.24
IUPAC NameN-nonan-2-yl-1-propan-2-ylpyrazol-4-amine
SMILESCCCCCCCC(C)Nc1cnn(C(C)C)c1
InChIInChI=1S/C15H29N3/c1-5-6-7-8-9-10-14(4)17-15-11-16-18(12-15)13(2)3/h11-14,17H,5-10H2,1-4H3
InChIKeyUGBNGIZKIXALSD-UHFFFAOYSA-N
XLogP4.62
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.42
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[(2R)-heptan-2-yl]-1-methylpyrazol-4-amine
CID 93104217
1-N,4-N-bis[(2R)-nonan-2-yl]benzene-1,4-diamine
CID 98160565
2-[4-(heptan-2-ylamino)pyrazol-1-yl]acetamide
CID 43695034
N-(3-methylbutyl)-1-propan-2-ylpyrazol-4-amine
CID 62903175
5-methyl-N-octan-2-ylpyridin-3-amine
CID 107584780
6-bromo-N-nonan-2-ylpyridin-3-amine
CID 114051593
N-pentan-2-yl-1-propylpyrazol-4-amine
CID 115921377
4-methyl-1-(2-methylpropyl)-N-octan-2-ylimidazol-2-amine
CID 106564935
1-propan-2-yl-N-[1-(4-propylphenyl)ethyl]pyrazol-4-amine
CID 62903879
3,5-dichloro-N-nonan-2-ylaniline
CID 55199203
1-butyl-N-heptan-2-yl-4-methylimidazol-2-amine
CID 106568860
N-[(1-propan-2-ylpyrazol-4-yl)methyl]heptan-1-amine;hydrochloride
CID 126967235

Frequently Asked Questions

What is the IUPAC name of N-nonan-2-yl-1-propan-2-ylpyrazol-4-amine?
The IUPAC name of N-nonan-2-yl-1-propan-2-ylpyrazol-4-amine (CID 63478238) is N-nonan-2-yl-1-propan-2-ylpyrazol-4-amine.
What is the SMILES notation for N-nonan-2-yl-1-propan-2-ylpyrazol-4-amine?
The canonical SMILES for N-nonan-2-yl-1-propan-2-ylpyrazol-4-amine is CCCCCCCC(C)Nc1cnn(C(C)C)c1.
What is the InChIKey of N-nonan-2-yl-1-propan-2-ylpyrazol-4-amine?
The InChIKey is UGBNGIZKIXALSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3/c1-5-6-7-8-9-10-14(4)17-15-11-16-18(12-15)13(2)3/h11-14,17H,5-10H2,1-4H3.
What are the key properties of N-nonan-2-yl-1-propan-2-ylpyrazol-4-amine?
N-nonan-2-yl-1-propan-2-ylpyrazol-4-amine has a molecular weight of 251.42 g/mol, XLogP of 4.62, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-nonan-2-yl-1-propan-2-ylpyrazol-4-amine is sourced from PubChem (CID 63478238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).