6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide

C16H24N4O3 — CID 109352486

IUPAC6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide
SMILESCCN(CC)C(=O)c1cc(N2CCC3(CC2)OCCO3)ncn1
InChIInChI=1S/C16H24N4O3/c1-3-19(4-2)15(21)13-11-14(18-12-17-13)20-7-5-16(6-8-20)22-9-10-23-16/h11-12H,3-10H2,1-2H3
InChIKeyDHKIEIAJAZTGHE-UHFFFAOYSA-N
MW320.39 g/mol
LogP1.30
Rot. Bonds4

About 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide

6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide (PubChem CID 109352486) has the molecular formula C16H24N4O3 and a molecular weight of 320.39 g/mol. Its IUPAC name is 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide
PubChem CID109352486
Molecular FormulaC16H24N4O3
Molecular Weight320.39 g/mol
Exact Mass320.18
IUPAC Name6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide
SMILESCCN(CC)C(=O)c1cc(N2CCC3(CC2)OCCO3)ncn1
InChIInChI=1S/C16H24N4O3/c1-3-19(4-2)15(21)13-11-14(18-12-17-13)20-7-5-16(6-8-20)22-9-10-23-16/h11-12H,3-10H2,1-2H3
InChIKeyDHKIEIAJAZTGHE-UHFFFAOYSA-N
XLogP1.30
TPSA67.79 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(3R,4S)-3-fluoro-4-propan-2-yloxypiperidin-1-yl]-pyrimidin-4-ylmethanone
CID 121261823
6-(4,4-difluoropiperidine-1-carbonyl)-N,N-dimethylpyrimidin-4-amine
CID 126857132
[2,6-Bis(dimethylamino)pyrimidin-4-yl]-(2,6-dimethylmorpholin-4-yl)methanone
CID 4674169
Ethyl 4-(6-(pyrrolidin-1-yl)pyrimidine-4-carboxamido)piperidine-1-carboxylate
CID 91628612
1,4-Dioxa-8-azaspiro[4.5]decan-8-yl pyrimidine-4-carboxamide
CID 19787950
N-(2-methoxyethyl)-6-(piperidin-1-yl)pyrimidine-4-carboxamide
CID 46178488
6-[(3S,4S)-3-amino-4-(2-oxopiperidin-1-yl)pyrrolidin-1-yl]-N,N-dimethylpyrimidine-4-carboxamide
CID 57559197
(6-aminopyrimidin-4-yl)-[4-[[(3R,4R)-3-methoxyoxan-4-yl]amino]piperidin-1-yl]methanone
CID 68331200
Tert-butyl 4-(6-carbamoylpyrimidin-4-yl)piperazine-1-carboxylate
CID 69648872
6-[4-methoxybutan-2-yl(methyl)amino]-N-(2-methoxyethyl)-N-methylpyrimidine-4-carboxamide
CID 90452819
6-[(1-Acetylpiperidin-4-yl)amino]pyrimidine-4-carboxamide
CID 118617057
6-[4-methoxybutan-2-yl(methyl)amino]-N,N-dimethylpyrimidine-4-carboxamide
CID 118972969

Frequently Asked Questions

What is the IUPAC name of 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide?
The IUPAC name of 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide (CID 109352486) is 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide.
What is the SMILES notation for 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide?
The canonical SMILES for 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide is CCN(CC)C(=O)c1cc(N2CCC3(CC2)OCCO3)ncn1.
What is the InChIKey of 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide?
The InChIKey is DHKIEIAJAZTGHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O3/c1-3-19(4-2)15(21)13-11-14(18-12-17-13)20-7-5-16(6-8-20)22-9-10-23-16/h11-12H,3-10H2,1-2H3.
What are the key properties of 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide?
6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide has a molecular weight of 320.39 g/mol, XLogP of 1.30, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpyrimidine-4-carboxamide is sourced from PubChem (CID 109352486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).