N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide

C11H22N2O2 — CID 64549727

IUPACN-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide
SMILESCCC(C)(CO)NC(=O)C1(C)CCNC1
InChIInChI=1S/C11H22N2O2/c1-4-11(3,8-14)13-9(15)10(2)5-6-12-7-10/h12,14H,4-8H2,1-3H3,(H,13,15)
InChIKeyNTUVVPTWAXBFBA-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.26
Rot. Bonds4

About N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide

N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide (PubChem CID 64549727) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide
PubChem CID64549727
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide
SMILESCCC(C)(CO)NC(=O)C1(C)CCNC1
InChIInChI=1S/C11H22N2O2/c1-4-11(3,8-14)13-9(15)10(2)5-6-12-7-10/h12,14H,4-8H2,1-3H3,(H,13,15)
InChIKeyNTUVVPTWAXBFBA-UHFFFAOYSA-N
XLogP0.26
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
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

N-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide
CID 66185354
methyl 2-methyl-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate
CID 63139390
1-amino-N-(1-hydroxy-2-methylbutan-2-yl)cyclopropane-1-carboxamide
CID 65457260
2-ethyl-2-[[(3-methylpyrrolidine-3-carbonyl)amino]methyl]butanoic acid
CID 113308641
N-(1-chloro-2-methylbutan-2-yl)-1-methylcyclohexane-1-carboxamide
CID 106829007
4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide
CID 106328694
N-(3,3-dimethylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide
CID 104828260
3-methyl-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119726405
2-ethyl-2-[(4-methylpiperidine-4-carbonyl)amino]butanoic acid
CID 79803552
2-[(3-methylpyrrolidine-3-carbonyl)amino]acetic acid
CID 63143746
N-[1-(tert-butylamino)-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide
CID 113266401
2,2-dimethyl-1-(3-methylpyrrolidin-3-yl)propan-1-one
CID 116570035

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide (CID 64549727) is N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide is CCC(C)(CO)NC(=O)C1(C)CCNC1.
What is the InChIKey of N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide?
The InChIKey is NTUVVPTWAXBFBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-4-11(3,8-14)13-9(15)10(2)5-6-12-7-10/h12,14H,4-8H2,1-3H3,(H,13,15).
What are the key properties of N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide?
N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 0.26, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 64549727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).