(5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane

C19H27N5 — CID 97450006

IUPAC(5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane
SMILESCn1ccnc1CN1CC[C@@]2(CCCN(Cc3ccccn3)C2)C1
InChIInChI=1S/C19H27N5/c1-22-12-9-21-18(22)14-24-11-7-19(16-24)6-4-10-23(15-19)13-17-5-2-3-8-20-17/h2-3,5,8-9,12H,4,6-7,10-11,13-16H2,1H3/t19-/m1/s1
InChIKeyHVGLDYOQQYHBFI-LJQANCHMSA-N
MW325.46 g/mol
LogP2.30
Rot. Bonds4

About (5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane

(5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane (PubChem CID 97450006) has the molecular formula C19H27N5 and a molecular weight of 325.46 g/mol. Its IUPAC name is (5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name(5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane
PubChem CID97450006
Molecular FormulaC19H27N5
Molecular Weight325.46 g/mol
Exact Mass325.23
IUPAC Name(5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane
SMILESCn1ccnc1CN1CC[C@@]2(CCCN(Cc3ccccn3)C2)C1
InChIInChI=1S/C19H27N5/c1-22-12-9-21-18(22)14-24-11-7-19(16-24)6-4-10-23(15-19)13-17-5-2-3-8-20-17/h2-3,5,8-9,12H,4,6-7,10-11,13-16H2,1H3/t19-/m1/s1
InChIKeyHVGLDYOQQYHBFI-LJQANCHMSA-N
XLogP2.30
TPSA37.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.46
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane with MolForge

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

Launch Full Analysis

Related Compounds

2,9-bis(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane
CID 131649183
(5S)-2-[(5-methylthiophen-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane
CID 97370344
9-(2-methoxyethyl)-2-[(1-methylimidazol-2-yl)methyl]-2,9-diazaspiro[5.5]undecane
CID 97484524
3-(pyridin-2-ylmethyl)-9-(2-pyrrolidin-1-ylethyl)-3,9-diazaspiro[5.5]undecane
CID 97450332
2-(oxan-4-yl)-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane
CID 131652843
(5R)-2-[[(3S)-oxolan-3-yl]methyl]-7-(pyridin-2-ylmethyl)-2,7-diazaspiro[4.5]decane
CID 97450038
2-methoxy-1-[9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decan-2-yl]ethanone
CID 131651444
3-methyl-1-(pyridin-2-ylmethyl)piperidin-3-ol
CID 115873664
(3R)-3-fluoro-3-methyl-1-[(1-methylimidazol-2-yl)methyl]piperidine
CID 129488138
pyridin-4-yl-[9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decan-2-yl]methanone
CID 131649206
9-(2-phenoxyethyl)-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane;2,2,2-trifluoroacetic acid
CID 155827464
9-cyclopropylsulfonyl-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[5.5]undecane
CID 97450461

Frequently Asked Questions

What is the IUPAC name of (5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane?
The IUPAC name of (5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane (CID 97450006) is (5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane.
What is the SMILES notation for (5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane?
The canonical SMILES for (5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane is Cn1ccnc1CN1CC[C@@]2(CCCN(Cc3ccccn3)C2)C1.
What is the InChIKey of (5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane?
The InChIKey is HVGLDYOQQYHBFI-LJQANCHMSA-N. The full InChI is InChI=1S/C19H27N5/c1-22-12-9-21-18(22)14-24-11-7-19(16-24)6-4-10-23(15-19)13-17-5-2-3-8-20-17/h2-3,5,8-9,12H,4,6-7,10-11,13-16H2,1H3/t19-/m1/s1.
What are the key properties of (5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane?
(5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane has a molecular weight of 325.46 g/mol, XLogP of 2.30, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-2-[(1-methylimidazol-2-yl)methyl]-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane is sourced from PubChem (CID 97450006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).