N-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide

C12H23N3O — CID 23140103

IUPACN-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide
SMILESCN(C)C1CN(C(=O)NC2CCCCC2)C1
InChIInChI=1S/C12H23N3O/c1-14(2)11-8-15(9-11)12(16)13-10-6-4-3-5-7-10/h10-11H,3-9H2,1-2H3,(H,13,16)
InChIKeyYWHPUEFSNPELLI-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.27
Rot. Bonds2

About N-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide

N-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide (PubChem CID 23140103) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is N-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide
PubChem CID23140103
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC NameN-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide
SMILESCN(C)C1CN(C(=O)NC2CCCCC2)C1
InChIInChI=1S/C12H23N3O/c1-14(2)11-8-15(9-11)12(16)13-10-6-4-3-5-7-10/h10-11H,3-9H2,1-2H3,(H,13,16)
InChIKeyYWHPUEFSNPELLI-UHFFFAOYSA-N
XLogP1.27
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Cyclohexyl-3-methylurea
CID 308344
N-Cyclohexyl-N'-heptylurea
CID 4089246
N-(Sec-butyl)-N'-cyclohexylurea
CID 4417023
1-Cyclohexyl-3-hexyl urea
CID 5151394
1-Cyclohexyl-3-isopropylurea
CID 280348
1-Butyl-3-cyclohexylurea
CID 3613676
Urea, N'-cyclohexyl-N,N-dimethyl-
CID 4594662
1-Cyclohexyl-3-ethylurea
CID 5151398
1-Cyclohexyl-3-propylurea
CID 280347
1,3-Dicyclohexyl-1-methylurea
CID 853664
N-[2-(diethylamino)ethyl](cyclohexylamino)carboxamide
CID 2054543
N-cyclohexyl-4-methylpiperazine-1-carboxamide
CID 306772

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide?
The IUPAC name of N-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide (CID 23140103) is N-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide is CN(C)C1CN(C(=O)NC2CCCCC2)C1.
What is the InChIKey of N-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide?
The InChIKey is YWHPUEFSNPELLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-14(2)11-8-15(9-11)12(16)13-10-6-4-3-5-7-10/h10-11H,3-9H2,1-2H3,(H,13,16).
What are the key properties of N-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide?
N-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide has a molecular weight of 225.34 g/mol, XLogP of 1.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(dimethylamino)azetidine-1-carboxamide is sourced from PubChem (CID 23140103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).