2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane

C19H34FN3 — CID 174349706

IUPAC2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane
SMILESCC(C)N1CC(F)(CN2CC3(CCN(CC4(C)CC4)CC3)C2)C1
InChIInChI=1S/C19H34FN3/c1-16(2)23-14-19(20,15-23)13-22-11-18(12-22)6-8-21(9-7-18)10-17(3)4-5-17/h16H,4-15H2,1-3H3
InChIKeyAYZSGGQFUVNNPD-UHFFFAOYSA-N
MW323.50 g/mol
LogP2.62
Rot. Bonds5

About 2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane

2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane (PubChem CID 174349706) has the molecular formula C19H34FN3 and a molecular weight of 323.50 g/mol. Its IUPAC name is 2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane
PubChem CID174349706
Molecular FormulaC19H34FN3
Molecular Weight323.50 g/mol
Exact Mass323.27
IUPAC Name2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane
SMILESCC(C)N1CC(F)(CN2CC3(CCN(CC4(C)CC4)CC3)C2)C1
InChIInChI=1S/C19H34FN3/c1-16(2)23-14-19(20,15-23)13-22-11-18(12-22)6-8-21(9-7-18)10-17(3)4-5-17/h16H,4-15H2,1-3H3
InChIKeyAYZSGGQFUVNNPD-UHFFFAOYSA-N
XLogP2.62
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.50
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane?
The IUPAC name of 2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane (CID 174349706) is 2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane.
What is the SMILES notation for 2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane?
The canonical SMILES for 2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane is CC(C)N1CC(F)(CN2CC3(CCN(CC4(C)CC4)CC3)C2)C1.
What is the InChIKey of 2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane?
The InChIKey is AYZSGGQFUVNNPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34FN3/c1-16(2)23-14-19(20,15-23)13-22-11-18(12-22)6-8-21(9-7-18)10-17(3)4-5-17/h16H,4-15H2,1-3H3.
What are the key properties of 2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane?
2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane has a molecular weight of 323.50 g/mol, XLogP of 2.62, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluoro-1-propan-2-ylazetidin-3-yl)methyl]-7-[(1-methylcyclopropyl)methyl]-2,7-diazaspiro[3.5]nonane is sourced from PubChem (CID 174349706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).