N-pentyl-2-pyrrolidin-1-ylpyridin-3-amine

C14H23N3 — CID 43676361

IUPACN-pentyl-2-pyrrolidin-1-ylpyridin-3-amine
SMILESCCCCCNc1cccnc1N1CCCC1
InChIInChI=1S/C14H23N3/c1-2-3-4-9-15-13-8-7-10-16-14(13)17-11-5-6-12-17/h7-8,10,15H,2-6,9,11-12H2,1H3
InChIKeyCIIUPDJDBJLWCA-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.28
Rot. Bonds6

About N-pentyl-2-pyrrolidin-1-ylpyridin-3-amine

N-pentyl-2-pyrrolidin-1-ylpyridin-3-amine (PubChem CID 43676361) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-pentyl-2-pyrrolidin-1-ylpyridin-3-amine.

Molecular Properties

Compound NameN-pentyl-2-pyrrolidin-1-ylpyridin-3-amine
PubChem CID43676361
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN-pentyl-2-pyrrolidin-1-ylpyridin-3-amine
SMILESCCCCCNc1cccnc1N1CCCC1
InChIInChI=1S/C14H23N3/c1-2-3-4-9-15-13-8-7-10-16-14(13)17-11-5-6-12-17/h7-8,10,15H,2-6,9,11-12H2,1H3
InChIKeyCIIUPDJDBJLWCA-UHFFFAOYSA-N
XLogP3.28
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.28
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'-tert-butyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)ethane-1,2-diamine
CID 107444893
N-pentyl-2-pyrazol-1-ylpyridin-3-amine
CID 43736889
N-nonan-2-yl-2-pyrrolidin-1-ylpyridin-3-amine
CID 43676446
N-heptyl-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 60945336
N-hexyl-2-(1,2,4-triazol-1-yl)pyridin-3-amine
CID 61167520
2-bromo-N-pentylpyridin-3-amine
CID 88814302
N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine
CID 114555031
N-(1-ethylsulfonylpropan-2-yl)-2-pyrrolidin-1-ylpyridin-3-amine
CID 115922139
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine
CID 60982261
2-ethoxy-N-octylpyridin-3-amine
CID 43706171
N-heptylquinolin-8-amine
CID 43130175
N-[(5-methylthiophen-2-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine
CID 43676368

Frequently Asked Questions

What is the IUPAC name of N-pentyl-2-pyrrolidin-1-ylpyridin-3-amine?
The IUPAC name of N-pentyl-2-pyrrolidin-1-ylpyridin-3-amine (CID 43676361) is N-pentyl-2-pyrrolidin-1-ylpyridin-3-amine.
What is the SMILES notation for N-pentyl-2-pyrrolidin-1-ylpyridin-3-amine?
The canonical SMILES for N-pentyl-2-pyrrolidin-1-ylpyridin-3-amine is CCCCCNc1cccnc1N1CCCC1.
What is the InChIKey of N-pentyl-2-pyrrolidin-1-ylpyridin-3-amine?
The InChIKey is CIIUPDJDBJLWCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-2-3-4-9-15-13-8-7-10-16-14(13)17-11-5-6-12-17/h7-8,10,15H,2-6,9,11-12H2,1H3.
What are the key properties of N-pentyl-2-pyrrolidin-1-ylpyridin-3-amine?
N-pentyl-2-pyrrolidin-1-ylpyridin-3-amine has a molecular weight of 233.36 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentyl-2-pyrrolidin-1-ylpyridin-3-amine is sourced from PubChem (CID 43676361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).