9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane

C15H26N4 — CID 131951949

IUPAC9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane
SMILESCn1nccc1CN1CCCC2(CCNCC2)CC1
InChIInChI=1S/C15H26N4/c1-18-14(3-8-17-18)13-19-11-2-4-15(7-12-19)5-9-16-10-6-15/h3,8,16H,2,4-7,9-13H2,1H3
InChIKeyYBFPLRDGDJHVMX-UHFFFAOYSA-N
MW262.40 g/mol
LogP1.78
Rot. Bonds2

About 9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane

9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane (PubChem CID 131951949) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane.

Molecular Properties

Compound Name9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane
PubChem CID131951949
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane
SMILESCn1nccc1CN1CCCC2(CCNCC2)CC1
InChIInChI=1S/C15H26N4/c1-18-14(3-8-17-18)13-19-11-2-4-15(7-12-19)5-9-16-10-6-15/h3,8,16H,2,4-7,9-13H2,1H3
InChIKeyYBFPLRDGDJHVMX-UHFFFAOYSA-N
XLogP1.78
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane 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-[(2-methylpyrazol-3-yl)methyl]-2,7-diazaspiro[4.4]nonane;hydrochloride
CID 120908563
[4-methyl-1-[(2-methylpyrazol-3-yl)methyl]piperidin-4-yl]methanol
CID 104694713
9-[(5-methyl-1H-imidazol-2-yl)methyl]-3,9-diazaspiro[5.6]dodecane
CID 77096135
9-(pyrazolo[1,5-a]pyrimidin-3-ylmethyl)-3,9-diazaspiro[5.6]dodecane;dihydrochloride
CID 154906451
9-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3,9-diazaspiro[5.6]dodecane
CID 74248039
2-(3,9-diazaspiro[5.6]dodecan-9-ylmethyl)-4-methyl-1,3-thiazole;dihydrochloride
CID 154902980
1-[2-(2-methylpyrazol-3-yl)ethyl]piperazine
CID 82606001
1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine
CID 63255576
3-methyl-1-[(2-methylpyrazol-3-yl)methyl]piperidine
CID 129199078
(E)-4-methyl-1-[8-[(2-methylpyrazol-3-yl)methyl]-2,8-diazaspiro[5.5]undecan-2-yl]pent-2-en-1-one
CID 155878259
1'-[(2-methylpyrazol-3-yl)methyl]spiro[3,4-dihydro-1,4-benzoxazepine-2,4'-piperidine]-5-one
CID 134788591
2-chloro-4-(3,9-diazaspiro[5.6]dodecan-9-ylmethyl)phenol;dihydrochloride
CID 154885693

Frequently Asked Questions

What is the IUPAC name of 9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane?
The IUPAC name of 9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane (CID 131951949) is 9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane.
What is the SMILES notation for 9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane?
The canonical SMILES for 9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane is Cn1nccc1CN1CCCC2(CCNCC2)CC1.
What is the InChIKey of 9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane?
The InChIKey is YBFPLRDGDJHVMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-18-14(3-8-17-18)13-19-11-2-4-15(7-12-19)5-9-16-10-6-15/h3,8,16H,2,4-7,9-13H2,1H3.
What are the key properties of 9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane?
9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane has a molecular weight of 262.40 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(2-methylpyrazol-3-yl)methyl]-3,9-diazaspiro[5.6]dodecane is sourced from PubChem (CID 131951949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).