[3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone

C16H23N3O2 — CID 136566370

IUPAC[3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
SMILESO=C(c1n[nH]c2c1CCCC2)N1CCOCC1CC1CC1
InChIInChI=1S/C16H23N3O2/c20-16(15-13-3-1-2-4-14(13)17-18-15)19-7-8-21-10-12(19)9-11-5-6-11/h11-12H,1-10H2,(H,17,18)
InChIKeyQLGPQBPBHAHCHJ-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.93
Rot. Bonds3

About [3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone

[3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone (PubChem CID 136566370) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is [3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone.

Molecular Properties

Compound Name[3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
PubChem CID136566370
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name[3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
SMILESO=C(c1n[nH]c2c1CCCC2)N1CCOCC1CC1CC1
InChIInChI=1S/C16H23N3O2/c20-16(15-13-3-1-2-4-14(13)17-18-15)19-7-8-21-10-12(19)9-11-5-6-11/h11-12H,1-10H2,(H,17,18)
InChIKeyQLGPQBPBHAHCHJ-UHFFFAOYSA-N
XLogP1.93
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
CID 125018147
1,4,5,6,7,8-hexahydrocyclohepta[d]pyrazol-3-yl-[(2R,5R)-5-(hydroxymethyl)-2-methylpiperidin-1-yl]methanone
CID 100690716
N-cyclopropyl-N-(oxolan-3-ylmethyl)-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxamide
CID 78880532
(3-aminopyrrolidin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
CID 112708550
[3-(cyclopropylmethyl)morpholin-4-yl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)methanone
CID 136566415
oxazinan-2-yl(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
CID 99789755
[(2R)-2-[(4-methylpyrazol-1-yl)methyl]piperidin-1-yl]-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-yl)methanone
CID 95603260
[2-(2-hydroxy-2-phenylethyl)pyrrolidin-1-yl]-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-yl)methanone
CID 111472262
[3-(cyclopropylmethyl)morpholin-4-yl]-(2-pyrazol-1-yl-4-pyridinyl)methanone
CID 136566386
[(2R)-2-[8-(cyclopropylmethyl)-4-methyl-6,7-dihydro-5H-pyrido[2,3-d]pyrimidin-2-yl]piperidin-1-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
CID 92622030
(2,6-dimethylpiperidin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
CID 110674214
(3-hydroxypiperidin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
CID 110889660

Frequently Asked Questions

What is the IUPAC name of [3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone?
The IUPAC name of [3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone (CID 136566370) is [3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone.
What is the SMILES notation for [3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone?
The canonical SMILES for [3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone is O=C(c1n[nH]c2c1CCCC2)N1CCOCC1CC1CC1.
What is the InChIKey of [3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone?
The InChIKey is QLGPQBPBHAHCHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c20-16(15-13-3-1-2-4-14(13)17-18-15)19-7-8-21-10-12(19)9-11-5-6-11/h11-12H,1-10H2,(H,17,18).
What are the key properties of [3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone?
[3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone has a molecular weight of 289.38 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(cyclopropylmethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone is sourced from PubChem (CID 136566370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).