1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine

C10H20N2O — CID 61462196

IUPAC1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine
SMILESCN1CCC(NC2CCOCC2)C1
InChIInChI=1S/C10H20N2O/c1-12-5-2-10(8-12)11-9-3-6-13-7-4-9/h9-11H,2-8H2,1H3
InChIKeyHOPHZIOKGSGCAC-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.46
Rot. Bonds2

About 1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine

1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine (PubChem CID 61462196) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine
PubChem CID61462196
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine
SMILESCN1CCC(NC2CCOCC2)C1
InChIInChI=1S/C10H20N2O/c1-12-5-2-10(8-12)11-9-3-6-13-7-4-9/h9-11H,2-8H2,1H3
InChIKeyHOPHZIOKGSGCAC-UHFFFAOYSA-N
XLogP0.46
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-N-(oxetan-3-yl)pyrrolidin-3-amine
CID 63623290
(3S)-1-(cyclopropylmethyl)-N-(oxan-4-yl)pyrrolidin-3-amine
CID 97068723
1-methyl-N-(oxolan-3-yl)azepan-4-amine
CID 80712996
4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide
CID 61462070
N-(1-methylpyrrolidin-3-yl)azepan-4-amine
CID 103981819
(3R)-1-methyl-N-(4-methyloxan-4-yl)pyrrolidin-3-amine
CID 167503529
N-(3-methoxycyclobutyl)-1-methylpyrrolidin-3-amine
CID 104871437
cyclopropyl-[3-(oxan-4-ylamino)pyrrolidin-1-yl]methanone
CID 172908968
N-cyclopentyloxan-4-amine
CID 28694035
N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride
CID 53408550
(3S)-N-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]-1-methylpyrrolidin-3-amine
CID 124710062
1-N-(1-methylpiperidin-4-yl)cyclobutane-1,3-diamine
CID 80559526

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine?
The IUPAC name of 1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine (CID 61462196) is 1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine.
What is the SMILES notation for 1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine?
The canonical SMILES for 1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine is CN1CCC(NC2CCOCC2)C1.
What is the InChIKey of 1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine?
The InChIKey is HOPHZIOKGSGCAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-12-5-2-10(8-12)11-9-3-6-13-7-4-9/h9-11H,2-8H2,1H3.
What are the key properties of 1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine?
1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine has a molecular weight of 184.28 g/mol, XLogP of 0.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine is sourced from PubChem (CID 61462196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).