1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol

C15H25N3O — CID 114678935

IUPAC1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol
SMILESCCNC(C)c1ccnc(N2CCC(O)C(C)C2)c1
InChIInChI=1S/C15H25N3O/c1-4-16-12(3)13-5-7-17-15(9-13)18-8-6-14(19)11(2)10-18/h5,7,9,11-12,14,16,19H,4,6,8,10H2,1-3H3
InChIKeyVMSGESJNDVVAQV-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.96
Rot. Bonds4

About 1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol

1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol (PubChem CID 114678935) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol
PubChem CID114678935
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol
SMILESCCNC(C)c1ccnc(N2CCC(O)C(C)C2)c1
InChIInChI=1S/C15H25N3O/c1-4-16-12(3)13-5-7-17-15(9-13)18-8-6-14(19)11(2)10-18/h5,7,9,11-12,14,16,19H,4,6,8,10H2,1-3H3
InChIKeyVMSGESJNDVVAQV-UHFFFAOYSA-N
XLogP1.96
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-4-methylpiperidin-3-ol
CID 102958933
N-ethyl-1-[2-(3-methoxypiperidin-1-yl)-4-pyridinyl]ethanamine
CID 102959126
[1-[4-[1-(methylamino)ethyl]-2-pyridinyl]pyrrolidin-3-yl]methanol
CID 112626014
N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine
CID 103496916
1-[2-bromo-4-[1-(ethylamino)ethyl]phenyl]-4-methylpiperidin-3-ol
CID 102958895
1-[1-[5-[1-(ethylamino)ethyl]-2-pyridinyl]pyrrolidin-3-yl]ethanol
CID 112626053
N-ethyl-1-[1-(4-methyl-2-pyridinyl)piperidin-3-yl]ethanamine
CID 63854038
1-[4-[1-(ethylamino)ethyl]phenyl]pyrrolidin-3-ol
CID 55130210
4-propan-2-yl-2-[3-(trifluoromethyl)pyrrolidin-1-yl]pyridine
CID 130437349
1-[2-(azetidin-1-yl)-4-pyridinyl]-N-methylethanamine
CID 130547348
1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol
CID 114681950
N-ethyl-1-[4-(3-methoxy-4-methylpiperidin-1-yl)phenyl]ethanamine
CID 102958936

Frequently Asked Questions

What is the IUPAC name of 1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol?
The IUPAC name of 1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol (CID 114678935) is 1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol.
What is the SMILES notation for 1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol?
The canonical SMILES for 1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol is CCNC(C)c1ccnc(N2CCC(O)C(C)C2)c1.
What is the InChIKey of 1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol?
The InChIKey is VMSGESJNDVVAQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-16-12(3)13-5-7-17-15(9-13)18-8-6-14(19)11(2)10-18/h5,7,9,11-12,14,16,19H,4,6,8,10H2,1-3H3.
What are the key properties of 1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol?
1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol has a molecular weight of 263.38 g/mol, XLogP of 1.96, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol is sourced from PubChem (CID 114678935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).