(3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine

C10H20N2O — CID 91584709

IUPAC(3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine
SMILESCC1COCCC1N[C@@H]1CCNC1
InChIInChI=1S/C10H20N2O/c1-8-7-13-5-3-10(8)12-9-2-4-11-6-9/h8-12H,2-7H2,1H3/t8?,9-,10?/m1/s1
InChIKeySVSFCCCVJXATPE-HWOCKDDLSA-N
MW184.28 g/mol
LogP0.36
Rot. Bonds2

About (3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine

(3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine (PubChem CID 91584709) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is (3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine.

Molecular Properties

Compound Name(3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine
PubChem CID91584709
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name(3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine
SMILESCC1COCCC1N[C@@H]1CCNC1
InChIInChI=1S/C10H20N2O/c1-8-7-13-5-3-10(8)12-9-2-4-11-6-9/h8-12H,2-7H2,1H3/t8?,9-,10?/m1/s1
InChIKeySVSFCCCVJXATPE-HWOCKDDLSA-N
XLogP0.36
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine?
The IUPAC name of (3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine (CID 91584709) is (3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine.
What is the SMILES notation for (3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine?
The canonical SMILES for (3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine is CC1COCCC1N[C@@H]1CCNC1.
What is the InChIKey of (3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine?
The InChIKey is SVSFCCCVJXATPE-HWOCKDDLSA-N. The full InChI is InChI=1S/C10H20N2O/c1-8-7-13-5-3-10(8)12-9-2-4-11-6-9/h8-12H,2-7H2,1H3/t8?,9-,10?/m1/s1.
What are the key properties of (3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine?
(3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine has a molecular weight of 184.28 g/mol, XLogP of 0.36, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(3-methyloxan-4-yl)pyrrolidin-3-amine is sourced from PubChem (CID 91584709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).