ethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen

C10H26N2 — CID 142616980

IUPACethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen
SMILESCC.CC(C)N1CC[C@@](C)(N)C1.[H][H]
InChIInChI=1S/C8H18N2.C2H6.H2/c1-7(2)10-5-4-8(3,9)6-10;1-2;/h7H,4-6,9H2,1-3H3;1-2H3;1H/t8-;;/m1../s1
InChIKeyWVAUOYHDHNBDKM-YCBDHFTFSA-N
MW174.33 g/mol
LogP2.09
Rot. Bonds1

About ethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen

ethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen (PubChem CID 142616980) has the molecular formula C10H26N2 and a molecular weight of 174.33 g/mol. Its IUPAC name is ethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen.

Molecular Properties

Compound Nameethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen
PubChem CID142616980
Molecular FormulaC10H26N2
Molecular Weight174.33 g/mol
Exact Mass174.21
IUPAC Nameethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen
SMILESCC.CC(C)N1CC[C@@](C)(N)C1.[H][H]
InChIInChI=1S/C8H18N2.C2H6.H2/c1-7(2)10-5-4-8(3,9)6-10;1-2;/h7H,4-6,9H2,1-3H3;1-2H3;1H/t8-;;/m1../s1
InChIKeyWVAUOYHDHNBDKM-YCBDHFTFSA-N
XLogP2.09
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.33
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen?
The IUPAC name of ethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen (CID 142616980) is ethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen.
What is the SMILES notation for ethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen?
The canonical SMILES for ethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen is CC.CC(C)N1CC[C@@](C)(N)C1.[H][H].
What is the InChIKey of ethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen?
The InChIKey is WVAUOYHDHNBDKM-YCBDHFTFSA-N. The full InChI is InChI=1S/C8H18N2.C2H6.H2/c1-7(2)10-5-4-8(3,9)6-10;1-2;/h7H,4-6,9H2,1-3H3;1-2H3;1H/t8-;;/m1../s1.
What are the key properties of ethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen?
ethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen has a molecular weight of 174.33 g/mol, XLogP of 2.09, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(3R)-3-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen is sourced from PubChem (CID 142616980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).