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

C11H22N2O2 — CID 103713703

IUPACN-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-1-carboxamide
SMILESCC(C)C(CCO)NC(=O)N1CCCC1
InChIInChI=1S/C11H22N2O2/c1-9(2)10(5-8-14)12-11(15)13-6-3-4-7-13/h9-10,14H,3-8H2,1-2H3,(H,12,15)
InChIKeyZVBCLONVXYPOAH-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.20
Rot. Bonds4

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

N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-1-carboxamide (PubChem CID 103713703) 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-1-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-1-carboxamide
PubChem CID103713703
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-1-carboxamide
SMILESCC(C)C(CCO)NC(=O)N1CCCC1
InChIInChI=1S/C11H22N2O2/c1-9(2)10(5-8-14)12-11(15)13-6-3-4-7-13/h9-10,14H,3-8H2,1-2H3,(H,12,15)
InChIKeyZVBCLONVXYPOAH-UHFFFAOYSA-N
XLogP1.20
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclopropanecarbonyl)-N-(1-hydroxy-4-methylpentan-3-yl)piperidine-3-carboxamide
CID 103750955
N-(1-hydroxypropan-2-yl)azepane-1-carboxamide
CID 112729482
N-butan-2-ylpyrrolidine-1-carboxamide
CID 17217776
N-pentan-2-ylazepane-1-carboxamide
CID 115583076
N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide
CID 115590525
N-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide
CID 106357280
N-propan-2-ylazetidine-1-carboxamide
CID 126972093
(2S)-2-(piperidine-1-carbonylamino)propanoic acid
CID 945005
N-(1-piperidin-1-ylpropan-2-yl)azepane-1-carboxamide
CID 115583840
N-(1-piperidin-1-ylpropan-2-yl)piperidine-1-carboxamide
CID 115579823
N-[4-(dimethylamino)butan-2-yl]pyrrolidine-1-carboxamide
CID 115596643
N-pent-4-yn-2-ylazepane-1-carboxamide
CID 115667497

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-1-carboxamide (CID 103713703) is N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-1-carboxamide is CC(C)C(CCO)NC(=O)N1CCCC1.
What is the InChIKey of N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-1-carboxamide?
The InChIKey is ZVBCLONVXYPOAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9(2)10(5-8-14)12-11(15)13-6-3-4-7-13/h9-10,14H,3-8H2,1-2H3,(H,12,15).
What are the key properties of N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-1-carboxamide?
N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-1-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 1.20, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 103713703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).