9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one

C19H27N5O2 — CID 134076269

IUPAC9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one
SMILESO=C(c1cnccn1)N1CCCC2(CCN(CCN3CCCC3)C2=O)C1
InChIInChI=1S/C19H27N5O2/c25-17(16-14-20-6-7-21-16)24-10-3-4-19(15-24)5-11-23(18(19)26)13-12-22-8-1-2-9-22/h6-7,14H,1-5,8-13,15H2
InChIKeyXMFYSQNJWNHRMK-UHFFFAOYSA-N
MW357.46 g/mol
LogP1.03
Rot. Bonds4

About 9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one

9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one (PubChem CID 134076269) has the molecular formula C19H27N5O2 and a molecular weight of 357.46 g/mol. Its IUPAC name is 9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one
PubChem CID134076269
Molecular FormulaC19H27N5O2
Molecular Weight357.46 g/mol
Exact Mass357.22
IUPAC Name9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one
SMILESO=C(c1cnccn1)N1CCCC2(CCN(CCN3CCCC3)C2=O)C1
InChIInChI=1S/C19H27N5O2/c25-17(16-14-20-6-7-21-16)24-10-3-4-19(15-24)5-11-23(18(19)26)13-12-22-8-1-2-9-22/h6-7,14H,1-5,8-13,15H2
InChIKeyXMFYSQNJWNHRMK-UHFFFAOYSA-N
XLogP1.03
TPSA69.64 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(5R)-2-[(3-methylphenyl)methyl]-7-(pyrazine-2-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one
CID 97451541
N,N-dimethyl-2-[1-oxo-8-(pyrazine-2-carbonyl)-2,8-diazaspiro[4.5]decan-2-yl]acetamide
CID 97370251
8-(3-pyrimidin-5-ylpropanoyl)-2-(2-pyrrolidin-1-ylethyl)-2,8-diazaspiro[3.5]nonan-3-one
CID 131683728
1-piperidin-1-yl-3-[4-(pyrazine-2-carbonyl)piperazin-1-yl]propan-1-one
CID 110664962
2-(2-morpholin-4-ylethyl)-7-[4-(trifluoromethyl)pyridine-3-carbonyl]-2,7-diazaspiro[4.4]nonan-1-one
CID 175644031
2-[2-(dimethylamino)ethyl]-9-(2-methyl-1,3-thiazole-4-carbonyl)-2,9-diazaspiro[4.5]decan-1-one
CID 131681877
[(5S)-7-(pyrazine-2-carbonyl)-2,7-diazaspiro[4.5]decan-2-yl]-pyridin-4-ylmethanone
CID 97370481
(5R)-2-[(6-methyl-2-pyridinyl)methyl]-9-(pyridine-2-carbonyl)-2,9-diazaspiro[4.5]decan-1-one
CID 97372107
[9-(2-methoxyethyl)-2,9-diazaspiro[5.5]undecan-2-yl]-pyrazin-2-ylmethanone;2,2,2-trifluoroacetic acid
CID 155835644
2-(2-phenylethyl)-7-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]-2,7-diazaspiro[4.4]nonan-1-one
CID 175645650
[8-(2-methoxyethyl)-2,8-diazaspiro[4.5]decan-2-yl]-pyrazin-2-ylmethanone
CID 97385388
9-(pyridazine-4-carbonyl)-2-(pyridin-4-ylmethyl)-2,9-diazaspiro[4.5]decan-1-one
CID 131641976

Frequently Asked Questions

What is the IUPAC name of 9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one?
The IUPAC name of 9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one (CID 134076269) is 9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one.
What is the SMILES notation for 9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one?
The canonical SMILES for 9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one is O=C(c1cnccn1)N1CCCC2(CCN(CCN3CCCC3)C2=O)C1.
What is the InChIKey of 9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one?
The InChIKey is XMFYSQNJWNHRMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O2/c25-17(16-14-20-6-7-21-16)24-10-3-4-19(15-24)5-11-23(18(19)26)13-12-22-8-1-2-9-22/h6-7,14H,1-5,8-13,15H2.
What are the key properties of 9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one?
9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one has a molecular weight of 357.46 g/mol, XLogP of 1.03, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(pyrazine-2-carbonyl)-2-(2-pyrrolidin-1-ylethyl)-2,9-diazaspiro[4.5]decan-1-one is sourced from PubChem (CID 134076269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).