N-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide

C21H35N3O2 — CID 97128681

IUPACN-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide
SMILESO=C(CN1CCC[C@@]2(CCC(=O)N(CC3CC3)C2)C1)NC1CCCCC1
InChIInChI=1S/C21H35N3O2/c25-19(22-18-5-2-1-3-6-18)14-23-12-4-10-21(15-23)11-9-20(26)24(16-21)13-17-7-8-17/h17-18H,1-16H2,(H,22,25)/t21-/m1/s1
InChIKeyANTUVCDRWXSTGU-OAQYLSRUSA-N
MW361.53 g/mol
LogP2.55
Rot. Bonds5

About N-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide

N-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide (PubChem CID 97128681) has the molecular formula C21H35N3O2 and a molecular weight of 361.53 g/mol. Its IUPAC name is N-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide
PubChem CID97128681
Molecular FormulaC21H35N3O2
Molecular Weight361.53 g/mol
Exact Mass361.27
IUPAC NameN-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide
SMILESO=C(CN1CCC[C@@]2(CCC(=O)N(CC3CC3)C2)C1)NC1CCCCC1
InChIInChI=1S/C21H35N3O2/c25-19(22-18-5-2-1-3-6-18)14-23-12-4-10-21(15-23)11-9-20(26)24(16-21)13-17-7-8-17/h17-18H,1-16H2,(H,22,25)/t21-/m1/s1
InChIKeyANTUVCDRWXSTGU-OAQYLSRUSA-N
XLogP2.55
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.53
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylmethyl)-8-(2-hydroxyacetyl)-2,8-diazaspiro[5.5]undecan-3-one
CID 72916173
N-cyclooctyl-2-(2-oxopyrrolidin-1-yl)acetamide
CID 39954322
2-[2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]pyridine-4-carboxylic acid
CID 70718159
(6R)-2-(cyclopropylmethyl)-N-[(4-methylphenyl)methyl]-3-oxo-2,8-diazaspiro[5.5]undecane-8-carboxamide
CID 97132229
(6S)-2-(cyclopropylmethyl)-8-morpholin-4-ylsulfonyl-2,8-diazaspiro[5.5]undecan-3-one
CID 97116245
2-(cyclopropylmethyl)-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one
CID 70777892
3-[2-(cyclohexylamino)-2-oxoethyl]-3-azabicyclo[4.1.0]heptane-1-carboxylic acid
CID 82363389
2-(2-benzyl-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl)-N-tert-butylacetamide
CID 70739252
2-[(6R)-2-benzyl-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-N-tert-butylacetamide
CID 95871224
N-cyclooctyl-2-[(4R,5S)-4-methoxy-7-azaspiro[4.5]decan-7-yl]acetamide
CID 135104203
N-cyclopentyl-10-(cyclopropylmethyl)-1-methyl-9-oxo-1,4,10-triazaspiro[5.6]dodecane-4-carboxamide
CID 70725318
N-cyclohexyl-2-[3-(hydroxymethyl)-3-prop-2-enylpiperidin-1-yl]acetamide
CID 72871248

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide?
The IUPAC name of N-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide (CID 97128681) is N-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide.
What is the SMILES notation for N-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide?
The canonical SMILES for N-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide is O=C(CN1CCC[C@@]2(CCC(=O)N(CC3CC3)C2)C1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide?
The InChIKey is ANTUVCDRWXSTGU-OAQYLSRUSA-N. The full InChI is InChI=1S/C21H35N3O2/c25-19(22-18-5-2-1-3-6-18)14-23-12-4-10-21(15-23)11-9-20(26)24(16-21)13-17-7-8-17/h17-18H,1-16H2,(H,22,25)/t21-/m1/s1.
What are the key properties of N-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide?
N-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide has a molecular weight of 361.53 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[(6R)-2-(cyclopropylmethyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]acetamide is sourced from PubChem (CID 97128681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).