2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine

C14H28N2O — CID 159141092

IUPAC2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine
SMILESCC(C)(C)NC[C@H]1CC[C@@H](N2CCOCC2)C1
InChIInChI=1S/C14H28N2O/c1-14(2,3)15-11-12-4-5-13(10-12)16-6-8-17-9-7-16/h12-13,15H,4-11H2,1-3H3/t12-,13+/m0/s1
InChIKeyVGYRFPROSAPUGH-QWHCGFSZSA-N
MW240.39 g/mol
LogP1.88
Rot. Bonds3

About 2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine

2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine (PubChem CID 159141092) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine
PubChem CID159141092
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine
SMILESCC(C)(C)NC[C@H]1CC[C@@H](N2CCOCC2)C1
InChIInChI=1S/C14H28N2O/c1-14(2,3)15-11-12-4-5-13(10-12)16-6-8-17-9-7-16/h12-13,15H,4-11H2,1-3H3/t12-,13+/m0/s1
InChIKeyVGYRFPROSAPUGH-QWHCGFSZSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine (CID 159141092) is 2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine is CC(C)(C)NC[C@H]1CC[C@@H](N2CCOCC2)C1.
What is the InChIKey of 2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine?
The InChIKey is VGYRFPROSAPUGH-QWHCGFSZSA-N. The full InChI is InChI=1S/C14H28N2O/c1-14(2,3)15-11-12-4-5-13(10-12)16-6-8-17-9-7-16/h12-13,15H,4-11H2,1-3H3/t12-,13+/m0/s1.
What are the key properties of 2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine?
2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine has a molecular weight of 240.39 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[(1S,3R)-3-morpholin-4-ylcyclopentyl]methyl]propan-2-amine is sourced from PubChem (CID 159141092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).