[4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone

C17H33N3O — CID 142350034

IUPAC[4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone
SMILESCCN1CCC(C(=O)N2CCC(N(CC)CC)CC2)CC1
InChIInChI=1S/C17H33N3O/c1-4-18-11-7-15(8-12-18)17(21)20-13-9-16(10-14-20)19(5-2)6-3/h15-16H,4-14H2,1-3H3
InChIKeyXDJDLLMWAQNRPW-UHFFFAOYSA-N
MW295.47 g/mol
LogP2.05
Rot. Bonds5

About [4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone

[4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone (PubChem CID 142350034) has the molecular formula C17H33N3O and a molecular weight of 295.47 g/mol. Its IUPAC name is [4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone.

Molecular Properties

Compound Name[4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone
PubChem CID142350034
Molecular FormulaC17H33N3O
Molecular Weight295.47 g/mol
Exact Mass295.26
IUPAC Name[4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone
SMILESCCN1CCC(C(=O)N2CCC(N(CC)CC)CC2)CC1
InChIInChI=1S/C17H33N3O/c1-4-18-11-7-15(8-12-18)17(21)20-13-9-16(10-14-20)19(5-2)6-3/h15-16H,4-14H2,1-3H3
InChIKeyXDJDLLMWAQNRPW-UHFFFAOYSA-N
XLogP2.05
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.47
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-acetyl-N-(1-propylpiperidin-4-yl)piperidine-4-carboxamide
CID 6467229
3-Piperidinecarboxamide, N,N-diethyl-1-hexyl-, monohydrobromide
CID 120537
N,N-dimethyl-1-(1-methylpiperidin-4-yl)piperidine-4-carboxamide
CID 97520888
1-[4-(Piperidine-1-carbonyl)piperidin-1-yl]ethanone
CID 60634762
N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide
CID 97406503
1-[1-(cyclopropylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide
CID 97406504
1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide
CID 97406505
1-(1-ethylpiperidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide
CID 97520889
N,N-dimethyl-1-[1-(2-methylpropyl)piperidin-4-yl]piperidine-4-carboxamide
CID 97520890
1-[4-(4-Methylpiperidine-1-carbonyl)piperidin-1-yl]ethanone
CID 110686014
1-acetyl-N-methyl-N-propan-2-ylpiperidine-4-carboxamide
CID 146018721
Cambridge id 5465862
CID 2846715

Frequently Asked Questions

What is the IUPAC name of [4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone?
The IUPAC name of [4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone (CID 142350034) is [4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone.
What is the SMILES notation for [4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone?
The canonical SMILES for [4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone is CCN1CCC(C(=O)N2CCC(N(CC)CC)CC2)CC1.
What is the InChIKey of [4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone?
The InChIKey is XDJDLLMWAQNRPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3O/c1-4-18-11-7-15(8-12-18)17(21)20-13-9-16(10-14-20)19(5-2)6-3/h15-16H,4-14H2,1-3H3.
What are the key properties of [4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone?
[4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone has a molecular weight of 295.47 g/mol, XLogP of 2.05, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(diethylamino)piperidin-1-yl]-(1-ethylpiperidin-4-yl)methanone is sourced from PubChem (CID 142350034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).