1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol

C17H29N3O2 — CID 138004521

IUPAC1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol
SMILESCCN(C)CC(O)CN1CCC(Oc2ccncc2C)CC1
InChIInChI=1S/C17H29N3O2/c1-4-19(3)12-15(21)13-20-9-6-16(7-10-20)22-17-5-8-18-11-14(17)2/h5,8,11,15-16,21H,4,6-7,9-10,12-13H2,1-3H3
InChIKeyOTLOWTRRARUICN-UHFFFAOYSA-N
MW307.44 g/mol
LogP1.55
Rot. Bonds7

About 1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol

1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol (PubChem CID 138004521) has the molecular formula C17H29N3O2 and a molecular weight of 307.44 g/mol. Its IUPAC name is 1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol.

Molecular Properties

Compound Name1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol
PubChem CID138004521
Molecular FormulaC17H29N3O2
Molecular Weight307.44 g/mol
Exact Mass307.23
IUPAC Name1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol
SMILESCCN(C)CC(O)CN1CCC(Oc2ccncc2C)CC1
InChIInChI=1S/C17H29N3O2/c1-4-19(3)12-15(21)13-20-9-6-16(7-10-20)22-17-5-8-18-11-14(17)2/h5,8,11,15-16,21H,4,6-7,9-10,12-13H2,1-3H3
InChIKeyOTLOWTRRARUICN-UHFFFAOYSA-N
XLogP1.55
TPSA48.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.44
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol with MolForge

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Launch Full Analysis

Related Compounds

2-cyclopropyl-2-methyl-1-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-1-one
CID 126811975
N-methyl-3-[[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]methyl]benzamide
CID 136543374
(4R)-1-ethyl-4-[4-[(3-methyl-4-pyridinyl)oxy]piperidine-1-carbonyl]pyrrolidin-2-one
CID 125139087
2-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]-5-pyridin-4-ylpyridine
CID 154781851
3-[[4-(2-methylphenoxy)piperidin-1-yl]methyl]pyridine
CID 56892936
4-ethyl-5-fluoro-6-[3-[(3-methyl-4-pyridinyl)oxy]pyrrolidin-1-yl]pyrimidine
CID 155975774
3-cyclopropyl-5-[3-[(3-methyl-4-pyridinyl)oxy]pyrrolidin-1-yl]-1,2,4-thiadiazole
CID 155975703
(2R)-1-amino-3-[4-(2,4-dichloro-3-methylphenoxy)piperidin-1-yl]propan-2-ol
CID 59296026
(3-cyclopropyl-1,2-oxazol-4-yl)-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]methanone
CID 126816278
1-[4-(3-chloro-4-methyl-2-sulfanylphenoxy)piperidin-1-yl]-3-(methylamino)propan-2-ol
CID 142274534
1-(4-ethylpiperazin-1-yl)-3-[2-methoxy-4-[[methyl-[(3-methyl-4-pyridinyl)methyl]amino]methyl]phenoxy]propan-2-ol
CID 45252103
5-ethyl-6-(1-methylpiperidin-4-yl)oxyisoquinoline
CID 70968627

Frequently Asked Questions

What is the IUPAC name of 1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol?
The IUPAC name of 1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol (CID 138004521) is 1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol.
What is the SMILES notation for 1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol?
The canonical SMILES for 1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol is CCN(C)CC(O)CN1CCC(Oc2ccncc2C)CC1.
What is the InChIKey of 1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol?
The InChIKey is OTLOWTRRARUICN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O2/c1-4-19(3)12-15(21)13-20-9-6-16(7-10-20)22-17-5-8-18-11-14(17)2/h5,8,11,15-16,21H,4,6-7,9-10,12-13H2,1-3H3.
What are the key properties of 1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol?
1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol has a molecular weight of 307.44 g/mol, XLogP of 1.55, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethyl(methyl)amino]-3-[4-[(3-methyl-4-pyridinyl)oxy]piperidin-1-yl]propan-2-ol is sourced from PubChem (CID 138004521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).