N-butylpyridin-2-amine

C9H14N2 — CID 14322668

IUPACN-butylpyridin-2-amine
SMILESCCCCNc1ccccn1
InChIInChI=1S/C9H14N2/c1-2-3-7-10-9-6-4-5-8-11-9/h4-6,8H,2-3,7H2,1H3,(H,10,11)
InChIKeyZBNJVQZTBKMTRK-UHFFFAOYSA-N
MW150.22 g/mol
LogP2.29
Rot. Bonds4

About N-butylpyridin-2-amine

N-butylpyridin-2-amine (PubChem CID 14322668) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is N-butylpyridin-2-amine.

Molecular Properties

Compound NameN-butylpyridin-2-amine
PubChem CID14322668
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC NameN-butylpyridin-2-amine
SMILESCCCCNc1ccccn1
InChIInChI=1S/C9H14N2/c1-2-3-7-10-9-6-4-5-8-11-9/h4-6,8H,2-3,7H2,1H3,(H,10,11)
InChIKeyZBNJVQZTBKMTRK-UHFFFAOYSA-N
XLogP2.29
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-butylpyridin-2-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-(3-butoxypropyl)pyridin-2-amine
CID 115569614
N,N'-dipyridin-2-ylnonane-1,9-diamine
CID 86213861
N-ethyl-N'-pyridin-2-ylpropane-1,3-diamine
CID 61020117
N-(3-chloropropyl)pyridin-2-amine
CID 22118637
N-(4-chlorobutyl)pyridin-2-amine
CID 106845032
N-(5-chloropentyl)pyridin-2-amine
CID 107320546
N-(4-methylsulfanylbutyl)pyridin-2-amine
CID 115637469
1-butyl-2-[4-(pyridin-2-ylamino)butyl]guanidine;hydroiodide
CID 111097152
N-pent-4-ynylpyridin-2-amine
CID 103704473
N-(2-fluoroethyl)pyridin-2-amine
CID 23204810
2-octyl-1-[4-(pyridin-2-ylamino)butyl]guanidine
CID 111097167
N-[4-(3-tributylstannylphenoxy)butyl]pyridin-2-amine
CID 22602741

Frequently Asked Questions

What is the IUPAC name of N-butylpyridin-2-amine?
The IUPAC name of N-butylpyridin-2-amine (CID 14322668) is N-butylpyridin-2-amine.
What is the SMILES notation for N-butylpyridin-2-amine?
The canonical SMILES for N-butylpyridin-2-amine is CCCCNc1ccccn1.
What is the InChIKey of N-butylpyridin-2-amine?
The InChIKey is ZBNJVQZTBKMTRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-2-3-7-10-9-6-4-5-8-11-9/h4-6,8H,2-3,7H2,1H3,(H,10,11).
What are the key properties of N-butylpyridin-2-amine?
N-butylpyridin-2-amine has a molecular weight of 150.22 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butylpyridin-2-amine is sourced from PubChem (CID 14322668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).