N-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide

C10H20N2O2 — CID 115303323

IUPACN-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide
SMILESCC1CCOC1C(=O)NCC(C)(C)N
InChIInChI=1S/C10H20N2O2/c1-7-4-5-14-8(7)9(13)12-6-10(2,3)11/h7-8H,4-6,11H2,1-3H3,(H,12,13)
InChIKeyKGADKDFSSUJOAP-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.26
Rot. Bonds3

About N-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide

N-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide (PubChem CID 115303323) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide
PubChem CID115303323
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide
SMILESCC1CCOC1C(=O)NCC(C)(C)N
InChIInChI=1S/C10H20N2O2/c1-7-4-5-14-8(7)9(13)12-6-10(2,3)11/h7-8H,4-6,11H2,1-3H3,(H,12,13)
InChIKeyKGADKDFSSUJOAP-UHFFFAOYSA-N
XLogP0.26
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-2-oxoethyl)-3-methyloxolane-2-carboxamide
CID 81450030
(2R,3S)-3-methyloxolane-2-carbohydrazide
CID 91654556
4,4-dimethyl-2-[[(3-methyloxolane-2-carbonyl)amino]methyl]pentanoic acid
CID 107474033
N-(2-amino-2-methylpropyl)oxane-4-carboxamide;hydrochloride
CID 119625667
N-(2-chloroprop-2-enyl)-3-methyloxolane-2-carboxamide
CID 115734116
N-(4-bromobutyl)-3-methyloxolane-2-carboxamide
CID 106845690
(2S,3R)-N-(2-chloroprop-2-enyl)-3-methyloxolane-2-carboxamide
CID 131019910
N-(3-iodopropyl)-3-methyloxolane-2-carboxamide
CID 114503961
N-(2-amino-2-methylpropyl)-2-methylcyclopropane-1-carboxamide
CID 81483791
N-(2-amino-2-methylpropyl)-3-methylcyclobutane-1-carboxamide
CID 130652190
(2R)-3,3-dimethyl-2-[(3-methyloxolane-2-carbonyl)amino]butanoic acid
CID 103926983
N-[[1-(hydroxymethyl)cyclohexyl]methyl]-3-methyloxolane-2-carboxamide
CID 112700992

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide?
The IUPAC name of N-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide (CID 115303323) is N-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide?
The canonical SMILES for N-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide is CC1CCOC1C(=O)NCC(C)(C)N.
What is the InChIKey of N-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide?
The InChIKey is KGADKDFSSUJOAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-7-4-5-14-8(7)9(13)12-6-10(2,3)11/h7-8H,4-6,11H2,1-3H3,(H,12,13).
What are the key properties of N-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide?
N-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide has a molecular weight of 200.28 g/mol, XLogP of 0.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-methylpropyl)-3-methyloxolane-2-carboxamide is sourced from PubChem (CID 115303323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).