1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine

C9H12N2 — CID 44542253

IUPAC1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine
SMILESC1=CCN(C2=NCCC2)C=C1
InChIInChI=1S/C9H12N2/c1-2-7-11(8-3-1)9-5-4-6-10-9/h1-3,7H,4-6,8H2
InChIKeyAMIANMAOMIAUJQ-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.56
Rot. Bonds

About 1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine

1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine (PubChem CID 44542253) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine
PubChem CID44542253
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine
SMILESC1=CCN(C2=NCCC2)C=C1
InChIInChI=1S/C9H12N2/c1-2-7-11(8-3-1)9-5-4-6-10-9/h1-3,7H,4-6,8H2
InChIKeyAMIANMAOMIAUJQ-UHFFFAOYSA-N
XLogP1.56
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Pyrido[1,2-a]pyrimidine
CID 20094215
3,4-Dihydro-2h-pyrido[1,2-a]pyrimidine
CID 21111582
1-(2H-pyridin-1-yl)-N-(trifluoromethyl)pentan-1-imine
CID 175548262
2-Pyrrolidin-1-ylazocine
CID 91200350
4-Ethylimidazo[1,2-a]pyridin-4-ium
CID 18001023
2,6,7,8-Tetrahydropyrrolo[1,2-a]pyrimidine
CID 19076061
4,6,7,8-Tetrahydropyrrolo[1,2-a]pyrimidine
CID 57907548
2-methyl-3-propyl-4H-pyrimidine
CID 68059140
(3S)-3-ethyl-2,3-dihydroimidazo[1,2-a]pyridine
CID 68357473
3,3-dimethyl-2-propyl-4H-pyrimidin-3-ium
CID 70223891
1,2-diethyl-4H-pyrimidine
CID 90757009
2-ethyl-3-methyl-4H-pyrimidine
CID 91507731

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine?
The IUPAC name of 1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine (CID 44542253) is 1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine?
The canonical SMILES for 1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine is C1=CCN(C2=NCCC2)C=C1.
What is the InChIKey of 1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine?
The InChIKey is AMIANMAOMIAUJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-2-7-11(8-3-1)9-5-4-6-10-9/h1-3,7H,4-6,8H2.
What are the key properties of 1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine?
1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine has a molecular weight of 148.21 g/mol, XLogP of 1.56, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-pyrrol-5-yl)-2H-pyridine is sourced from PubChem (CID 44542253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).