3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine

C10H22N2O — CID 82718601

IUPAC3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine
SMILESCCCN(C)C1(CN)CCOC1C
InChIInChI=1S/C10H22N2O/c1-4-6-12(3)10(8-11)5-7-13-9(10)2/h9H,4-8,11H2,1-3H3
InChIKeyBUQXHEFNMLFDIB-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.83
Rot. Bonds4

About 3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine

3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine (PubChem CID 82718601) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine
PubChem CID82718601
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine
SMILESCCCN(C)C1(CN)CCOC1C
InChIInChI=1S/C10H22N2O/c1-4-6-12(3)10(8-11)5-7-13-9(10)2/h9H,4-8,11H2,1-3H3
InChIKeyBUQXHEFNMLFDIB-UHFFFAOYSA-N
XLogP0.83
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(aminomethyl)-N-cyclopropyl-N,2-dimethyloxolan-3-amine
CID 82717506
3-(aminomethyl)-N-butyl-N-ethyl-2-methyloxolan-3-amine
CID 82717384
3-(aminomethyl)-N-cyclopentyl-N,2-dimethyloxolan-3-amine
CID 82717798
3-(aminomethyl)-N-butan-2-yl-N-butyl-2-methyloxolan-3-amine
CID 82717640
3-(aminomethyl)-2-methyl-N,N-bis(3-methylbutyl)oxolan-3-amine
CID 107869444
1-(aminomethyl)-N,2-dimethyl-N-propylcyclopentan-1-amine
CID 65045561
3-(aminomethyl)-2-methyl-N,N-bis(2-methylpropyl)oxolan-3-amine
CID 82719159
3-(aminomethyl)-N-[(3-bromophenyl)methyl]-N,2-dimethyloxolan-3-amine
CID 82717967
(3-ethyl-2-methyloxolan-3-yl)methanamine
CID 114533945
3-(aminomethyl)-N,2-dimethyl-N-(1-thiophen-2-ylpropan-2-yl)oxolan-3-amine
CID 82718623
3-(aminomethyl)-N-[1-(2-chlorophenyl)ethyl]-N,2-dimethyloxolan-3-amine
CID 82718464
1-(aminomethyl)-N,4-dimethyl-N-propylcycloheptan-1-amine
CID 65084771

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine?
The IUPAC name of 3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine (CID 82718601) is 3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine.
What is the SMILES notation for 3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine?
The canonical SMILES for 3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine is CCCN(C)C1(CN)CCOC1C.
What is the InChIKey of 3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine?
The InChIKey is BUQXHEFNMLFDIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-4-6-12(3)10(8-11)5-7-13-9(10)2/h9H,4-8,11H2,1-3H3.
What are the key properties of 3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine?
3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine has a molecular weight of 186.30 g/mol, XLogP of 0.83, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N,2-dimethyl-N-propyloxolan-3-amine is sourced from PubChem (CID 82718601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).