N-pentyl-1H-pyrazol-5-amine

C8H15N3 — CID 57317534

IUPACN-pentyl-1H-pyrazol-5-amine
SMILESCCCCCNc1ccn[nH]1
InChIInChI=1S/C8H15N3/c1-2-3-4-6-9-8-5-7-10-11-8/h5,7H,2-4,6H2,1H3,(H2,9,10,11)
InChIKeyLKYLAIJKVAHDJB-UHFFFAOYSA-N
MW153.23 g/mol
LogP2.01
Rot. Bonds5

About N-pentyl-1H-pyrazol-5-amine

N-pentyl-1H-pyrazol-5-amine (PubChem CID 57317534) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is N-pentyl-1H-pyrazol-5-amine.

Molecular Properties

Compound NameN-pentyl-1H-pyrazol-5-amine
PubChem CID57317534
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC NameN-pentyl-1H-pyrazol-5-amine
SMILESCCCCCNc1ccn[nH]1
InChIInChI=1S/C8H15N3/c1-2-3-4-6-9-8-5-7-10-11-8/h5,7H,2-4,6H2,1H3,(H2,9,10,11)
InChIKeyLKYLAIJKVAHDJB-UHFFFAOYSA-N
XLogP2.01
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-pentyl-1H-pyrazol-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4,4-dimethylpentyl)-1H-pyrazol-5-amine
CID 20774380
N-pentyl-3-(1H-pyrazol-5-yl)aniline
CID 43745298
2-(1H-pyrazol-5-ylamino)ethanol
CID 126655297
3-oxo-N-(1H-pyrazol-5-yl)nonanamide
CID 10130928
2-ethyl-N-(1H-pyrazol-5-yl)hexanamide
CID 61393178
5-pentyl-1H-pyrazole
CID 13433979
N-ethylsulfanyl-1H-pyrazol-5-amine
CID 139658544
2,6-diethyl-N-octylaniline
CID 63491055
2-(1H-pyrazol-5-ylamino)acetic acid
CID 19590120
2-chloro-N-dodecyl-6-methylaniline
CID 66252343
5-tridecan-7-yl-1H-pyrazole
CID 126625738
2-N,6-N-dipentylpyridine-2,6-diamine
CID 66709787

Frequently Asked Questions

What is the IUPAC name of N-pentyl-1H-pyrazol-5-amine?
The IUPAC name of N-pentyl-1H-pyrazol-5-amine (CID 57317534) is N-pentyl-1H-pyrazol-5-amine.
What is the SMILES notation for N-pentyl-1H-pyrazol-5-amine?
The canonical SMILES for N-pentyl-1H-pyrazol-5-amine is CCCCCNc1ccn[nH]1.
What is the InChIKey of N-pentyl-1H-pyrazol-5-amine?
The InChIKey is LKYLAIJKVAHDJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-2-3-4-6-9-8-5-7-10-11-8/h5,7H,2-4,6H2,1H3,(H2,9,10,11).
What are the key properties of N-pentyl-1H-pyrazol-5-amine?
N-pentyl-1H-pyrazol-5-amine has a molecular weight of 153.23 g/mol, XLogP of 2.01, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentyl-1H-pyrazol-5-amine is sourced from PubChem (CID 57317534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).