4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide

C13H25N3O2 — CID 83261087

IUPAC4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide
SMILESCN(C)C(=O)N1CCC(NCC2CC(O)C2)CC1
InChIInChI=1S/C13H25N3O2/c1-15(2)13(18)16-5-3-11(4-6-16)14-9-10-7-12(17)8-10/h10-12,14,17H,3-9H2,1-2H3
InChIKeyBLWPZDUFEJISIP-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.49
Rot. Bonds3

About 4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide

4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide (PubChem CID 83261087) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide
PubChem CID83261087
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide
SMILESCN(C)C(=O)N1CCC(NCC2CC(O)C2)CC1
InChIInChI=1S/C13H25N3O2/c1-15(2)13(18)16-5-3-11(4-6-16)14-9-10-7-12(17)8-10/h10-12,14,17H,3-9H2,1-2H3
InChIKeyBLWPZDUFEJISIP-UHFFFAOYSA-N
XLogP0.49
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(cyclopropylmethylamino)-N,N-dimethylpiperidine-1-carboxamide
CID 115307162
N,N-dimethyl-4-(oxan-4-ylmethylamino)piperidine-1-carboxamide
CID 83202827
N,N-dimethyl-4-(oxan-3-ylmethylamino)piperidine-1-carboxamide
CID 83202568
4-[[2-(hydroxymethyl)cyclohexyl]methylamino]-N,N-dimethylpiperidine-1-carboxamide
CID 83268946
N,N-dimethyl-4-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methylamino]piperidine-1-carboxamide
CID 129000271
N,N-dimethyl-4-[(1-methylpiperidin-2-yl)methylamino]piperidine-1-carboxamide
CID 83262363
methyl 2-[[1-(dimethylcarbamoyl)piperidin-4-yl]amino]acetate
CID 83224585
1-[4-[(4-hydroxycyclohexyl)methylamino]piperidin-1-yl]ethanone
CID 114146739
ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide
CID 177000200
4-[(3-hydroxycyclobutyl)methylamino]cyclohexan-1-ol
CID 106594762
4-(but-3-ynylamino)-N,N-dimethylpiperidine-1-carboxamide
CID 83262365
N,N-dimethyl-4-(2-methylsulfanylpropylamino)piperidine-1-carboxamide
CID 115899675

Frequently Asked Questions

What is the IUPAC name of 4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide?
The IUPAC name of 4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide (CID 83261087) is 4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide.
What is the SMILES notation for 4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide?
The canonical SMILES for 4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide is CN(C)C(=O)N1CCC(NCC2CC(O)C2)CC1.
What is the InChIKey of 4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide?
The InChIKey is BLWPZDUFEJISIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-15(2)13(18)16-5-3-11(4-6-16)14-9-10-7-12(17)8-10/h10-12,14,17H,3-9H2,1-2H3.
What are the key properties of 4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide?
4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide has a molecular weight of 255.36 g/mol, XLogP of 0.49, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-hydroxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide is sourced from PubChem (CID 83261087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).