(1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone

C15H26N4O — CID 114506616

IUPAC(1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone
SMILESCCNC1CCN(C(=O)c2cnn(C)c2C)CC1CC
InChIInChI=1S/C15H26N4O/c1-5-12-10-19(8-7-14(12)16-6-2)15(20)13-9-17-18(4)11(13)3/h9,12,14,16H,5-8,10H2,1-4H3
InChIKeyRSWPFJFZAJBZHF-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.58
Rot. Bonds4

About (1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone

(1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone (PubChem CID 114506616) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is (1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone
PubChem CID114506616
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name(1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone
SMILESCCNC1CCN(C(=O)c2cnn(C)c2C)CC1CC
InChIInChI=1S/C15H26N4O/c1-5-12-10-19(8-7-14(12)16-6-2)15(20)13-9-17-18(4)11(13)3/h9,12,14,16H,5-8,10H2,1-4H3
InChIKeyRSWPFJFZAJBZHF-UHFFFAOYSA-N
XLogP1.58
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1,5-dimethylpyrazol-4-yl)-[4-(ethylamino)piperidin-1-yl]methanone
CID 60818934
[3-ethyl-4-(ethylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone
CID 114506670
[3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-ethyl-1-methylpyrazol-4-yl)methanone
CID 102809881
[3-ethyl-4-(ethylamino)piperidin-1-yl]-(1-methylpyrazol-3-yl)methanone
CID 103115707
(2,5-dihydroxyphenyl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone
CID 107721232
[3-ethyl-4-(ethylamino)piperidin-1-yl]-(4-fluoro-2-methylphenyl)methanone
CID 114506842
(4-chloropiperidin-1-yl)-(1,5-dimethylpyrazol-4-yl)methanone
CID 63390631
(1,3-dimethylpyrazol-4-yl)-[3-ethyl-4-(propylamino)piperidin-1-yl]methanone
CID 102801020
(3-bromopiperidin-1-yl)-(1,5-dimethylpyrazol-4-yl)methanone
CID 80659902
(1,5-dimethylpyrazol-4-yl)-[3-[(1Z)-1-[ethylamino(prop-1-en-2-yl)amino]-3-methylbuta-1,3-dienyl]piperidin-1-yl]methanone
CID 144952121
[3-ethyl-4-(ethylamino)piperidin-1-yl]-(furan-2-yl)methanone
CID 114506827
(1,5-dimethylpyrazol-4-yl)-[2-(hydroxymethyl)morpholin-4-yl]methanone
CID 81207907

Frequently Asked Questions

What is the IUPAC name of (1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone?
The IUPAC name of (1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone (CID 114506616) is (1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone.
What is the SMILES notation for (1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone?
The canonical SMILES for (1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone is CCNC1CCN(C(=O)c2cnn(C)c2C)CC1CC.
What is the InChIKey of (1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone?
The InChIKey is RSWPFJFZAJBZHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-5-12-10-19(8-7-14(12)16-6-2)15(20)13-9-17-18(4)11(13)3/h9,12,14,16H,5-8,10H2,1-4H3.
What are the key properties of (1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone?
(1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone has a molecular weight of 278.40 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone is sourced from PubChem (CID 114506616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).