N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide

C11H22N2O2 — CID 103796571

IUPACN-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide
SMILESCC(C)C(CCO)NC(=O)C1CCCN1
InChIInChI=1S/C11H22N2O2/c1-8(2)9(5-7-14)13-11(15)10-4-3-6-12-10/h8-10,12,14H,3-7H2,1-2H3,(H,13,15)
InChIKeyJPVUQLZOEMAZAY-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.26
Rot. Bonds5

About N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide

N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide (PubChem CID 103796571) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide
PubChem CID103796571
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide
SMILESCC(C)C(CCO)NC(=O)C1CCCN1
InChIInChI=1S/C11H22N2O2/c1-8(2)9(5-7-14)13-11(15)10-4-3-6-12-10/h8-10,12,14H,3-7H2,1-2H3,(H,13,15)
InChIKeyJPVUQLZOEMAZAY-UHFFFAOYSA-N
XLogP0.26
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-(4-hydroxybutan-2-yl)piperidine-2-carboxamide
CID 104914608
N-(1-hydroxypentan-3-yl)pyrrolidine-2-carboxamide;hydrochloride
CID 110012241
4-hydroxy-2-[[(2R)-pyrrolidine-2-carbonyl]amino]butanoic acid
CID 104901043
(2R)-N-propan-2-ylpyrrolidine-2-carboxamide;hydrochloride
CID 139022811
N-[1-(dimethylamino)-3-methylbutan-2-yl]piperidine-2-carboxamide
CID 54958647
N-[1-(dimethylamino)-3-methylbutan-2-yl]azepane-2-carboxamide
CID 64562293
N-[(1R)-1-hydroxyethyl]pyrrolidine-2-carboxamide
CID 175256598
methyl (3R,4R)-4-hydroxy-3-[[(2S)-pyrrolidine-2-carbonyl]amino]pentanoate
CID 71251216
N-(1-hydroxy-4-methylpentan-3-yl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 103796563
N-(5-methylhexan-2-yl)piperidine-2-carboxamide
CID 43579330
N-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-2-carboxamide
CID 61246606
(2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride
CID 130736371

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide?
The IUPAC name of N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide (CID 103796571) is N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide is CC(C)C(CCO)NC(=O)C1CCCN1.
What is the InChIKey of N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide?
The InChIKey is JPVUQLZOEMAZAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-8(2)9(5-7-14)13-11(15)10-4-3-6-12-10/h8-10,12,14H,3-7H2,1-2H3,(H,13,15).
What are the key properties of N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide?
N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 0.26, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 103796571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).