4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide

C11H23N3O3 — CID 113349364

IUPAC4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide
SMILESCOCC(O)CCNC1CCN(C(N)=O)CC1
InChIInChI=1S/C11H23N3O3/c1-17-8-10(15)2-5-13-9-3-6-14(7-4-9)11(12)16/h9-10,13,15H,2-8H2,1H3,(H2,12,16)
InChIKeyUBYDLQGZWNZYJJ-UHFFFAOYSA-N
MW245.32 g/mol
LogP-0.48
Rot. Bonds6

About 4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide

4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide (PubChem CID 113349364) has the molecular formula C11H23N3O3 and a molecular weight of 245.32 g/mol. Its IUPAC name is 4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide
PubChem CID113349364
Molecular FormulaC11H23N3O3
Molecular Weight245.32 g/mol
Exact Mass245.17
IUPAC Name4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide
SMILESCOCC(O)CCNC1CCN(C(N)=O)CC1
InChIInChI=1S/C11H23N3O3/c1-17-8-10(15)2-5-13-9-3-6-14(7-4-9)11(12)16/h9-10,13,15H,2-8H2,1H3,(H2,12,16)
InChIKeyUBYDLQGZWNZYJJ-UHFFFAOYSA-N
XLogP-0.48
TPSA87.82 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 5-0.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-methoxy-4-[(4-propan-2-ylcyclohexyl)amino]butan-2-ol
CID 103876423
1-methoxy-4-[(4-propylcyclohexyl)amino]butan-2-ol
CID 103876239
4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide
CID 63824782
4-(hexylamino)piperidine-1-carboxamide
CID 43769692
4-(5-hydroxypentylamino)piperidine-1-carboxamide
CID 107302971
4-[(2-amino-2-oxoethyl)amino]piperidine-1-carboxamide
CID 43754739
3-[(3-hydroxy-4-methoxybutyl)amino]-1-methylpyrrolidin-2-one
CID 106246688
4-(cyclobutylmethylamino)piperidine-1-carboxamide
CID 43775245
4-(2-methylbutylamino)piperidine-1-carboxamide
CID 62692212
4-(2-cyclohexylethylamino)piperidine-1-carboxamide
CID 54931641
4-[3-(diethylamino)propylamino]piperidine-1-carboxamide
CID 43763196
4-(methylamino)piperidine-1-carboxamide
CID 43754889

Frequently Asked Questions

What is the IUPAC name of 4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide?
The IUPAC name of 4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide (CID 113349364) is 4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide.
What is the SMILES notation for 4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide?
The canonical SMILES for 4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide is COCC(O)CCNC1CCN(C(N)=O)CC1.
What is the InChIKey of 4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide?
The InChIKey is UBYDLQGZWNZYJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3/c1-17-8-10(15)2-5-13-9-3-6-14(7-4-9)11(12)16/h9-10,13,15H,2-8H2,1H3,(H2,12,16).
What are the key properties of 4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide?
4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide has a molecular weight of 245.32 g/mol, XLogP of -0.48, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-hydroxy-4-methoxybutyl)amino]piperidine-1-carboxamide is sourced from PubChem (CID 113349364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).