4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide

C11H23N3O2 — CID 79253533

IUPAC4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide
SMILESCC(C)C(CO)NC1CCN(C(N)=O)CC1
InChIInChI=1S/C11H23N3O2/c1-8(2)10(7-15)13-9-3-5-14(6-4-9)11(12)16/h8-10,13,15H,3-7H2,1-2H3,(H2,12,16)
InChIKeyBPBISVBOKIGCLK-UHFFFAOYSA-N
MW229.32 g/mol
LogP0.14
Rot. Bonds4

About 4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide

4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide (PubChem CID 79253533) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide
PubChem CID79253533
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide
SMILESCC(C)C(CO)NC1CCN(C(N)=O)CC1
InChIInChI=1S/C11H23N3O2/c1-8(2)10(7-15)13-9-3-5-14(6-4-9)11(12)16/h8-10,13,15H,3-7H2,1-2H3,(H2,12,16)
InChIKeyBPBISVBOKIGCLK-UHFFFAOYSA-N
XLogP0.14
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 50.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]piperidin-1-yl]ethanone
CID 79254180
4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide
CID 43776407
(2S)-3-methyl-2-[(1-methylpiperidin-4-yl)amino]butan-1-ol
CID 79253287
4-[[(1S)-1-cyclopentylethyl]amino]piperidine-1-carboxamide
CID 81386220
4-(methylamino)piperidine-1-carboxamide
CID 43754889
4-(2,3,3-trimethylbutylamino)piperidine-1-carboxamide
CID 81339135
4-(6-methylheptan-2-ylamino)piperidine-1-carboxamide
CID 43769257
(2S)-2-[(1,1-dioxothian-4-yl)amino]-3-methylbutan-1-ol
CID 79253470
(2S)-2-[(4,4-dimethylcyclohexyl)amino]-3-methylbutan-1-ol
CID 79254694
4-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]piperidine-1-carboxamide
CID 60932505
4-(2-methylbutylamino)piperidine-1-carboxamide
CID 62692212
2-[(3-aminocyclobutyl)amino]-3-methylbutan-1-ol
CID 80562093

Frequently Asked Questions

What is the IUPAC name of 4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide?
The IUPAC name of 4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide (CID 79253533) is 4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide.
What is the SMILES notation for 4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide?
The canonical SMILES for 4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide is CC(C)C(CO)NC1CCN(C(N)=O)CC1.
What is the InChIKey of 4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide?
The InChIKey is BPBISVBOKIGCLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-8(2)10(7-15)13-9-3-5-14(6-4-9)11(12)16/h8-10,13,15H,3-7H2,1-2H3,(H2,12,16).
What are the key properties of 4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide?
4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide has a molecular weight of 229.32 g/mol, XLogP of 0.14, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-hydroxy-3-methylbutan-2-yl)amino]piperidine-1-carboxamide is sourced from PubChem (CID 79253533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).