10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene

C19H33NO — CID 130371264

IUPAC10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene
SMILESC/C=C\C1=C(CC)CC2(CCN(C)CC2)CC1OC(C)C
InChIInChI=1S/C19H33NO/c1-6-8-17-16(7-2)13-19(9-11-20(5)12-10-19)14-18(17)21-15(3)4/h6,8,15,18H,7,9-14H2,1-5H3/b8-6-
InChIKeyZLMUXLOPNLWFFK-VURMDHGXSA-N
MW291.48 g/mol
LogP4.57
Rot. Bonds4

About 10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene

10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene (PubChem CID 130371264) has the molecular formula C19H33NO and a molecular weight of 291.48 g/mol. Its IUPAC name is 10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene.

Molecular Properties

Compound Name10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene
PubChem CID130371264
Molecular FormulaC19H33NO
Molecular Weight291.48 g/mol
Exact Mass291.26
IUPAC Name10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene
SMILESC/C=C\C1=C(CC)CC2(CCN(C)CC2)CC1OC(C)C
InChIInChI=1S/C19H33NO/c1-6-8-17-16(7-2)13-19(9-11-20(5)12-10-19)14-18(17)21-15(3)4/h6,8,15,18H,7,9-14H2,1-5H3/b8-6-
InChIKeyZLMUXLOPNLWFFK-VURMDHGXSA-N
XLogP4.57
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.48
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene?
The IUPAC name of 10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene (CID 130371264) is 10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene.
What is the SMILES notation for 10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene?
The canonical SMILES for 10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene is C/C=C\C1=C(CC)CC2(CCN(C)CC2)CC1OC(C)C.
What is the InChIKey of 10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene?
The InChIKey is ZLMUXLOPNLWFFK-VURMDHGXSA-N. The full InChI is InChI=1S/C19H33NO/c1-6-8-17-16(7-2)13-19(9-11-20(5)12-10-19)14-18(17)21-15(3)4/h6,8,15,18H,7,9-14H2,1-5H3/b8-6-.
What are the key properties of 10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene?
10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene has a molecular weight of 291.48 g/mol, XLogP of 4.57, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-ethyl-3-methyl-8-propan-2-yloxy-9-[(Z)-prop-1-enyl]-3-azaspiro[5.5]undec-9-ene is sourced from PubChem (CID 130371264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).