3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine

C12H24N2O — CID 103534683

IUPAC3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine
SMILESCOC1CCN(CC2CCCC(N)C2)C1
InChIInChI=1S/C12H24N2O/c1-15-12-5-6-14(9-12)8-10-3-2-4-11(13)7-10/h10-12H,2-9,13H2,1H3
InChIKeyRZNRVFSAVDWSPX-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.22
Rot. Bonds3

About 3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine

3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine (PubChem CID 103534683) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine
PubChem CID103534683
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine
SMILESCOC1CCN(CC2CCCC(N)C2)C1
InChIInChI=1S/C12H24N2O/c1-15-12-5-6-14(9-12)8-10-3-2-4-11(13)7-10/h10-12H,2-9,13H2,1H3
InChIKeyRZNRVFSAVDWSPX-UHFFFAOYSA-N
XLogP1.22
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-1-(cyclopentylmethyl)-3-methoxypyrrolidine
CID 126986050
3-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine
CID 63046292
ethane;4-[(3-methoxypyrrolidin-1-yl)methyl]-1-methylpiperidine
CID 142390528
3-(piperidin-1-ylmethyl)cyclohexan-1-amine
CID 63044906
3-(3-methoxypyrrolidin-1-yl)cyclohexan-1-amine
CID 103532352
3-[(3-methoxy-4-methylpiperidin-1-yl)methyl]cyclopentan-1-amine
CID 102963518
2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol
CID 103539245
3-[(4-ethyl-1,4-diazepan-1-yl)methyl]cyclohexan-1-amine
CID 167776529
(3S)-1-[(3-aminocyclopentyl)methyl]pyrrolidin-3-amine
CID 130625838
1-[2-(3-methoxypiperidin-1-yl)ethyl]piperidin-4-amine
CID 102963901
3-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-amine
CID 63045605
3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-amine
CID 63046291

Frequently Asked Questions

What is the IUPAC name of 3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine (CID 103534683) is 3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine is COC1CCN(CC2CCCC(N)C2)C1.
What is the InChIKey of 3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine?
The InChIKey is RZNRVFSAVDWSPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-15-12-5-6-14(9-12)8-10-3-2-4-11(13)7-10/h10-12H,2-9,13H2,1H3.
What are the key properties of 3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine?
3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine has a molecular weight of 212.34 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-methoxypyrrolidin-1-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 103534683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).