N-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide

C24H27N3O3 — CID 86945861

IUPACN-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide
SMILESCN(C)CCNC(=O)C1CCN(C(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)CC1
InChIInChI=1S/C24H27N3O3/c1-26(2)14-11-25-23(29)16-9-12-27(13-10-16)24(30)17-7-8-19-18-5-3-4-6-20(18)22(28)21(19)15-17/h3-8,15-16H,9-14H2,1-2H3,(H,25,29)
InChIKeyMMMKCJVDHQAVBD-UHFFFAOYSA-N
MW405.50 g/mol
LogP2.43
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide

N-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide (PubChem CID 86945861) has the molecular formula C24H27N3O3 and a molecular weight of 405.50 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide
PubChem CID86945861
Molecular FormulaC24H27N3O3
Molecular Weight405.50 g/mol
Exact Mass405.21
IUPAC NameN-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide
SMILESCN(C)CCNC(=O)C1CCN(C(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)CC1
InChIInChI=1S/C24H27N3O3/c1-26(2)14-11-25-23(29)16-9-12-27(13-10-16)24(30)17-7-8-19-18-5-3-4-6-20(18)22(28)21(19)15-17/h3-8,15-16H,9-14H2,1-2H3,(H,25,29)
InChIKeyMMMKCJVDHQAVBD-UHFFFAOYSA-N
XLogP2.43
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.50
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methoxypropyl)-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide
CID 55953433
N-[2-(dimethylamino)ethyl]-1-(3,4-dimethylbenzoyl)piperidine-4-carboxamide
CID 113003438
1-(3-chlorobenzoyl)-N-[2-(dimethylamino)ethyl]piperidine-4-carboxamide
CID 113003453
1-(9,10-dioxoanthracene-2-carbonyl)-N,N-diethylpiperidine-4-carboxamide
CID 16764901
2-(4-hydroxypiperidine-1-carbonyl)fluoren-9-one
CID 110883962
N-[2-(dimethylamino)ethyl]-1-[4-(trifluoromethyl)benzoyl]piperidine-4-carboxamide
CID 86915487
1-(9,10-dioxoanthracene-2-carbonyl)-N,N-dimethylpiperidine-4-sulfonamide
CID 175949360
2-[4-[[4-(cyclohexylmethylamino)butylamino]methyl]piperidine-1-carbonyl]anthracene-9,10-dione
CID 139906530
2-(4-phenylpiperidine-1-carbonyl)anthracene-9,10-dione
CID 633858
ethyl 4-(9-oxofluorene-2-carbonyl)piperazine-1-carboxylate
CID 17446072
1-(3,5-dimethoxybenzoyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide
CID 55719644
1-(2-cyclohexyl-1,3-dioxoisoindole-5-carbonyl)-N-pentylpiperidine-4-carboxamide
CID 55819361

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide (CID 86945861) is N-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide is CN(C)CCNC(=O)C1CCN(C(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)CC1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide?
The InChIKey is MMMKCJVDHQAVBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O3/c1-26(2)14-11-25-23(29)16-9-12-27(13-10-16)24(30)17-7-8-19-18-5-3-4-6-20(18)22(28)21(19)15-17/h3-8,15-16H,9-14H2,1-2H3,(H,25,29).
What are the key properties of N-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide?
N-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide has a molecular weight of 405.50 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-1-(9-oxofluorene-2-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 86945861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).