(5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one

C19H24N4O — CID 129483055

IUPAC(5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one
SMILESCn1cncc1[C@@H]1NC(=O)CC[C@H]1N[C@@H]1CCc2ccccc2C1
InChIInChI=1S/C19H24N4O/c1-23-12-20-11-17(23)19-16(8-9-18(24)22-19)21-15-7-6-13-4-2-3-5-14(13)10-15/h2-5,11-12,15-16,19,21H,6-10H2,1H3,(H,22,24)/t15-,16-,19-/m1/s1
InChIKeyPJUQEIDTJDUXPG-GPMSIDNRSA-N
MW324.43 g/mol
LogP1.89
Rot. Bonds3

About (5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one

(5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one (PubChem CID 129483055) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is (5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one.

Molecular Properties

Compound Name(5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one
PubChem CID129483055
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name(5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one
SMILESCn1cncc1[C@@H]1NC(=O)CC[C@H]1N[C@@H]1CCc2ccccc2C1
InChIInChI=1S/C19H24N4O/c1-23-12-20-11-17(23)19-16(8-9-18(24)22-19)21-15-7-6-13-4-2-3-5-14(13)10-15/h2-5,11-12,15-16,19,21H,6-10H2,1H3,(H,22,24)/t15-,16-,19-/m1/s1
InChIKeyPJUQEIDTJDUXPG-GPMSIDNRSA-N
XLogP1.89
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,2,3,3-tetramethyl-N-[(2R,3R)-2-(3-methylimidazol-4-yl)-6-oxopiperidin-3-yl]cyclopropane-1-carboxamide
CID 128983921
5-amino-6-(3-methylimidazol-4-yl)piperidin-2-one
CID 66118968
(5R,6R)-5-[[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]amino]-6-(2-methylpyrazol-3-yl)piperidin-2-one
CID 129482338
(5R,6S)-5-[[(2S)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]amino]-6-(1-methylpyrazol-4-yl)piperidin-2-one
CID 129474825
4-(3-methylimidazol-4-yl)-5-phenylpyrrolidin-2-one
CID 66118016
4-chloro-3-fluoro-N-[(2R,3R)-2-(3-methylimidazol-4-yl)-6-oxopiperidin-3-yl]benzamide
CID 128983929
4-fluoro-N-[(2R,3R)-2-(3-methylimidazol-4-yl)-6-oxopiperidin-3-yl]-1H-indole-2-carboxamide
CID 128988856
2,4-dimethyl-6-(1,2,3,4-tetrahydronaphthalen-2-ylamino)-1,2,4-triazine-3,5-dione
CID 60658790
N-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 63277998
(2R,4S)-N-[(2R)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-2-(3-methylimidazol-4-yl)oxan-4-amine
CID 129473939
N-(2,4-dimethylcyclohexyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 63995066
N-(2-tert-butylcyclohexyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 43223738

Frequently Asked Questions

What is the IUPAC name of (5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one?
The IUPAC name of (5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one (CID 129483055) is (5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one.
What is the SMILES notation for (5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one?
The canonical SMILES for (5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one is Cn1cncc1[C@@H]1NC(=O)CC[C@H]1N[C@@H]1CCc2ccccc2C1.
What is the InChIKey of (5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one?
The InChIKey is PJUQEIDTJDUXPG-GPMSIDNRSA-N. The full InChI is InChI=1S/C19H24N4O/c1-23-12-20-11-17(23)19-16(8-9-18(24)22-19)21-15-7-6-13-4-2-3-5-14(13)10-15/h2-5,11-12,15-16,19,21H,6-10H2,1H3,(H,22,24)/t15-,16-,19-/m1/s1.
What are the key properties of (5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one?
(5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one has a molecular weight of 324.43 g/mol, XLogP of 1.89, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R,6R)-6-(3-methylimidazol-4-yl)-5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]piperidin-2-one is sourced from PubChem (CID 129483055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).