N-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide

C9H18N2O3 — CID 65314727

IUPACN-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide
SMILESO=C(NC(CO)CO)C1CCNCC1
InChIInChI=1S/C9H18N2O3/c12-5-8(6-13)11-9(14)7-1-3-10-4-2-7/h7-8,10,12-13H,1-6H2,(H,11,14)
InChIKeyGJBQWHYVSNHLHN-UHFFFAOYSA-N
MW202.25 g/mol
LogP-1.54
Rot. Bonds4

About N-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide

N-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide (PubChem CID 65314727) has the molecular formula C9H18N2O3 and a molecular weight of 202.25 g/mol. Its IUPAC name is N-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide
PubChem CID65314727
Molecular FormulaC9H18N2O3
Molecular Weight202.25 g/mol
Exact Mass202.13
IUPAC NameN-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide
SMILESO=C(NC(CO)CO)C1CCNCC1
InChIInChI=1S/C9H18N2O3/c12-5-8(6-13)11-9(14)7-1-3-10-4-2-7/h7-8,10,12-13H,1-6H2,(H,11,14)
InChIKeyGJBQWHYVSNHLHN-UHFFFAOYSA-N
XLogP-1.54
TPSA81.59 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 5-1.54
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-hydroxy-4-methylpentan-2-yl)piperidine-4-carboxamide
CID 61246607
N-(5-methylhexan-2-yl)piperidine-4-carboxamide;hydrochloride
CID 119263583
N-[(1R)-2-hydroxy-1-phenylethyl]piperidine-4-carboxamide
CID 103951345
3-(piperidine-4-carbonylamino)butanoic acid
CID 61161192
N-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide
CID 61246468
N-(3-ethylpentan-2-yl)piperidine-4-carboxamide
CID 63842489
N-[(2S)-1-hydroxybutan-2-yl]cyclohexanecarboxamide
CID 854995
N-[1-(ethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide
CID 43579241
N-(1-hydroxy-2-methylpropan-2-yl)piperidine-4-carboxamide;hydrochloride
CID 44890741
N-(4-ethylsulfanylbutan-2-yl)piperidine-4-carboxamide
CID 115734464
5-(piperidine-4-carbonylamino)hexanoic acid
CID 82844939
N-(1-hydroxy-4-methylpentan-2-yl)cycloheptanecarboxamide
CID 62588514

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide?
The IUPAC name of N-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide (CID 65314727) is N-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide?
The canonical SMILES for N-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide is O=C(NC(CO)CO)C1CCNCC1.
What is the InChIKey of N-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide?
The InChIKey is GJBQWHYVSNHLHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3/c12-5-8(6-13)11-9(14)7-1-3-10-4-2-7/h7-8,10,12-13H,1-6H2,(H,11,14).
What are the key properties of N-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide?
N-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide has a molecular weight of 202.25 g/mol, XLogP of -1.54, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dihydroxypropan-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 65314727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).