(3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine

C10H22N2O — CID 103939668

IUPAC(3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine
SMILESCC(C)(C)OCCN1CC[C@@H](N)C1
InChIInChI=1S/C10H22N2O/c1-10(2,3)13-7-6-12-5-4-9(11)8-12/h9H,4-8,11H2,1-3H3/t9-/m1/s1
InChIKeyQLJBSJWXGCZSSV-SECBINFHSA-N
MW186.30 g/mol
LogP0.83
Rot. Bonds3

About (3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine

(3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine (PubChem CID 103939668) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is (3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine.

Molecular Properties

Compound Name(3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine
PubChem CID103939668
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name(3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine
SMILESCC(C)(C)OCCN1CC[C@@H](N)C1
InChIInChI=1S/C10H22N2O/c1-10(2,3)13-7-6-12-5-4-9(11)8-12/h9H,4-8,11H2,1-3H3/t9-/m1/s1
InChIKeyQLJBSJWXGCZSSV-SECBINFHSA-N
XLogP0.83
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
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

1-(2-Methoxyethyl)pyrrolidin-3-amine
CID 20800284
Morpholine, 4-(4-methyl-3-pyrrolidinyl)-
CID 73994640
rac-(3R,4R)-4-methoxy-1-methylpyrrolidin-3-amine
CID 75531171
1-[(3R)-3-aminopyrrolidin-1-yl]-2-methylpropan-2-ol
CID 94340735
1-(2-Morpholinoethyl)pyrrolidin-3-amine
CID 54593709
(3S)-1-cyclopropyl-N-[2-(2-methylpropoxy)ethyl]pyrrolidin-3-amine
CID 97230824
4-Methoxy-1-methylpyrrolidin-3-amine
CID 18985363
4-fluoro-N-(2-methoxyethyl)-1-methylpyrrolidin-3-amine
CID 176675939
(S)-1-(2-Methoxyethyl)pyrrolidin-3-amine
CID 10796871
4-Methyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]pyrrolidin-3-amine
CID 103577328
4-ethoxy-N-methylpyrrolidin-3-amine
CID 19969807
4-methoxy-N,N-dimethylpyrrolidin-3-amine
CID 19969837

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine?
The IUPAC name of (3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine (CID 103939668) is (3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine.
What is the SMILES notation for (3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine?
The canonical SMILES for (3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine is CC(C)(C)OCCN1CC[C@@H](N)C1.
What is the InChIKey of (3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine?
The InChIKey is QLJBSJWXGCZSSV-SECBINFHSA-N. The full InChI is InChI=1S/C10H22N2O/c1-10(2,3)13-7-6-12-5-4-9(11)8-12/h9H,4-8,11H2,1-3H3/t9-/m1/s1.
What are the key properties of (3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine?
(3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine has a molecular weight of 186.30 g/mol, XLogP of 0.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine is sourced from PubChem (CID 103939668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).