2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol

C20H22N4O — CID 135368501

IUPAC2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol
SMILESCC1(C)CC(O)CCN1c1cc(-c2ccncc2)nc2cnccc12
InChIInChI=1S/C20H22N4O/c1-20(2)12-15(25)6-10-24(20)19-11-17(14-3-7-21-8-4-14)23-18-13-22-9-5-16(18)19/h3-5,7-9,11,13,15,25H,6,10,12H2,1-2H3
InChIKeyMGVPIZXZVWAHPA-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.43
Rot. Bonds2

About 2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol

2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol (PubChem CID 135368501) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is 2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol.

Molecular Properties

Compound Name2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol
PubChem CID135368501
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC Name2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol
SMILESCC1(C)CC(O)CCN1c1cc(-c2ccncc2)nc2cnccc12
InChIInChI=1S/C20H22N4O/c1-20(2)12-15(25)6-10-24(20)19-11-17(14-3-7-21-8-4-14)23-18-13-22-9-5-16(18)19/h3-5,7-9,11,13,15,25H,6,10,12H2,1-2H3
InChIKeyMGVPIZXZVWAHPA-UHFFFAOYSA-N
XLogP3.43
TPSA62.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

CID 453063
CID 453063
CID 453068
CID 453068
CID 453071
CID 453071
CID 16188143
CID 16188143
CID 16189802
CID 16189802
CID 453059
CID 453059
CID 135390225
CID 135390225
CID 50939214
CID 50939214
CID 58379555
CID 58379555
CID 58379623
CID 58379623
CID 124089554
CID 124089554
CID 124089597
CID 124089597

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol?
The IUPAC name of 2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol (CID 135368501) is 2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol.
What is the SMILES notation for 2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol?
The canonical SMILES for 2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol is CC1(C)CC(O)CCN1c1cc(-c2ccncc2)nc2cnccc12.
What is the InChIKey of 2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol?
The InChIKey is MGVPIZXZVWAHPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-20(2)12-15(25)6-10-24(20)19-11-17(14-3-7-21-8-4-14)23-18-13-22-9-5-16(18)19/h3-5,7-9,11,13,15,25H,6,10,12H2,1-2H3.
What are the key properties of 2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol?
2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol has a molecular weight of 334.42 g/mol, XLogP of 3.43, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-(2-pyridin-4-yl-1,7-naphthyridin-4-yl)piperidin-4-ol is sourced from PubChem (CID 135368501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).