(3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine

C10H18N2O — CID 126745342

IUPAC(3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine
SMILESN[C@@H]1CC=C(CNCC2CC2)OC1
InChIInChI=1S/C10H18N2O/c11-9-3-4-10(13-7-9)6-12-5-8-1-2-8/h4,8-9,12H,1-3,5-7,11H2/t9-/m1/s1
InChIKeyREFUUMDBAVGBAW-SECBINFHSA-N
MW182.27 g/mol
LogP0.62
Rot. Bonds4

About (3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine

(3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine (PubChem CID 126745342) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is (3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine.

Molecular Properties

Compound Name(3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine
PubChem CID126745342
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name(3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine
SMILESN[C@@H]1CC=C(CNCC2CC2)OC1
InChIInChI=1S/C10H18N2O/c11-9-3-4-10(13-7-9)6-12-5-8-1-2-8/h4,8-9,12H,1-3,5-7,11H2/t9-/m1/s1
InChIKeyREFUUMDBAVGBAW-SECBINFHSA-N
XLogP0.62
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine?
The IUPAC name of (3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine (CID 126745342) is (3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine.
What is the SMILES notation for (3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine?
The canonical SMILES for (3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine is N[C@@H]1CC=C(CNCC2CC2)OC1.
What is the InChIKey of (3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine?
The InChIKey is REFUUMDBAVGBAW-SECBINFHSA-N. The full InChI is InChI=1S/C10H18N2O/c11-9-3-4-10(13-7-9)6-12-5-8-1-2-8/h4,8-9,12H,1-3,5-7,11H2/t9-/m1/s1.
What are the key properties of (3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine?
(3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine has a molecular weight of 182.27 g/mol, XLogP of 0.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-6-[(cyclopropylmethylamino)methyl]-3,4-dihydro-2H-pyran-3-amine is sourced from PubChem (CID 126745342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).