N-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine

C11H21NO — CID 103902167

IUPACN-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine
SMILESCC1OCCC1NCC1CC1(C)C
InChIInChI=1S/C11H21NO/c1-8-10(4-5-13-8)12-7-9-6-11(9,2)3/h8-10,12H,4-7H2,1-3H3
InChIKeyVQYJWLPJBHPZRG-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.80
Rot. Bonds3

About N-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine

N-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine (PubChem CID 103902167) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine.

Molecular Properties

Compound NameN-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine
PubChem CID103902167
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine
SMILESCC1OCCC1NCC1CC1(C)C
InChIInChI=1S/C11H21NO/c1-8-10(4-5-13-8)12-7-9-6-11(9,2)3/h8-10,12H,4-7H2,1-3H3
InChIKeyVQYJWLPJBHPZRG-UHFFFAOYSA-N
XLogP1.80
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,4S)-4-(2-fluoroethoxy)-2-propan-2-ylpyrrolidine
CID 99995025
(2R,4S)-4-(2-fluoroethoxy)-2-propan-2-ylpyrrolidine
CID 99995028
(2S,4R)-4-(2-fluoroethoxy)-2-propan-2-ylpyrrolidine
CID 99995031
(2R,4R)-4-(2-fluoroethoxy)-2-propan-2-ylpyrrolidine
CID 99995033
4-(2-Fluoro-ethoxy)-2-isopropyl-pyrrolidine
CID 102568647
3-[(2,2-Difluoro-3,3-dimethylcyclopropyl)methoxy]pyrrolidine hydrochloride
CID 126845117
3-[(2,2-Difluoro-3,3-dimethylcyclopropyl)methoxy]pyrrolidine
CID 126845118
2-[(2,2-Difluoro-3,3-dimethylcyclopropyl)methoxymethyl]pyrrolidine
CID 126845126
N-ethyl-2,4,5-trimethyloxolan-3-amine;lawrencium
CID 18339631
N-ethyl-2,4,5-trimethyloxolan-3-amine
CID 18339632
3-Tert-butyl-4-methoxypyrrolidine
CID 20792976
N-ethyl-2,4-dimethyloxolan-3-amine;lawrencium
CID 22896089

Frequently Asked Questions

What is the IUPAC name of N-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine?
The IUPAC name of N-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine (CID 103902167) is N-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine.
What is the SMILES notation for N-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine?
The canonical SMILES for N-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine is CC1OCCC1NCC1CC1(C)C.
What is the InChIKey of N-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine?
The InChIKey is VQYJWLPJBHPZRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-8-10(4-5-13-8)12-7-9-6-11(9,2)3/h8-10,12H,4-7H2,1-3H3.
What are the key properties of N-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine?
N-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine has a molecular weight of 183.29 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine is sourced from PubChem (CID 103902167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).