(3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol

C14H12Cl2N2O — CID 79781088

IUPAC(3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol
SMILESOC(c1ncc(Cl)cc1Cl)C1CCc2cccnc21
InChIInChI=1S/C14H12Cl2N2O/c15-9-6-11(16)13(18-7-9)14(19)10-4-3-8-2-1-5-17-12(8)10/h1-2,5-7,10,14,19H,3-4H2
InChIKeyCVVHRJFORWNXSZ-UHFFFAOYSA-N
MW295.17 g/mol
LogP3.55
Rot. Bonds2

About (3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol

(3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol (PubChem CID 79781088) has the molecular formula C14H12Cl2N2O and a molecular weight of 295.17 g/mol. Its IUPAC name is (3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol.

Molecular Properties

Compound Name(3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol
PubChem CID79781088
Molecular FormulaC14H12Cl2N2O
Molecular Weight295.17 g/mol
Exact Mass294.03
IUPAC Name(3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol
SMILESOC(c1ncc(Cl)cc1Cl)C1CCc2cccnc21
InChIInChI=1S/C14H12Cl2N2O/c15-9-6-11(16)13(18-7-9)14(19)10-4-3-8-2-1-5-17-12(8)10/h1-2,5-7,10,14,19H,3-4H2
InChIKeyCVVHRJFORWNXSZ-UHFFFAOYSA-N
XLogP3.55
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.17
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2,5-dichlorophenyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol
CID 115818219
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3,4,5-trifluorophenyl)methanol
CID 79739398
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol
CID 112575643
(3-chloro-4-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol
CID 105111318
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(5-methylfuran-2-yl)methanol
CID 79740317
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(4-ethoxyphenyl)methanol
CID 79739385
(5-chloro-2-methylphenyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol
CID 115818347
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(2,6-dimethoxyphenyl)methanol
CID 115819406
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol
CID 105112544
(4-bromo-3-methylphenyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol
CID 81447185
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanol
CID 115819504
6-bicyclo[3.1.0]hexanyl(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol
CID 115819421

Frequently Asked Questions

What is the IUPAC name of (3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol?
The IUPAC name of (3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol (CID 79781088) is (3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol.
What is the SMILES notation for (3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol?
The canonical SMILES for (3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol is OC(c1ncc(Cl)cc1Cl)C1CCc2cccnc21.
What is the InChIKey of (3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol?
The InChIKey is CVVHRJFORWNXSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O/c15-9-6-11(16)13(18-7-9)14(19)10-4-3-8-2-1-5-17-12(8)10/h1-2,5-7,10,14,19H,3-4H2.
What are the key properties of (3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol?
(3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol has a molecular weight of 295.17 g/mol, XLogP of 3.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol is sourced from PubChem (CID 79781088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).