10-(methylamino)spiro[4.5]decane-10-carbonitrile

C12H20N2 — CID 130592844

IUPAC10-(methylamino)spiro[4.5]decane-10-carbonitrile
SMILESCNC1(C#N)CCCCC12CCCC2
InChIInChI=1S/C12H20N2/c1-14-12(10-13)9-5-4-8-11(12)6-2-3-7-11/h14H,2-9H2,1H3
InChIKeyKZKFMRSCUFCVOS-UHFFFAOYSA-N
MW192.31 g/mol
LogP2.60
Rot. Bonds1

About 10-(methylamino)spiro[4.5]decane-10-carbonitrile

10-(methylamino)spiro[4.5]decane-10-carbonitrile (PubChem CID 130592844) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 10-(methylamino)spiro[4.5]decane-10-carbonitrile.

Molecular Properties

Compound Name10-(methylamino)spiro[4.5]decane-10-carbonitrile
PubChem CID130592844
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name10-(methylamino)spiro[4.5]decane-10-carbonitrile
SMILESCNC1(C#N)CCCCC12CCCC2
InChIInChI=1S/C12H20N2/c1-14-12(10-13)9-5-4-8-11(12)6-2-3-7-11/h14H,2-9H2,1H3
InChIKeyKZKFMRSCUFCVOS-UHFFFAOYSA-N
XLogP2.60
TPSA35.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(methylamino)cyclopentane-1-carbonitrile
CID 12945445
4-(cyclopropylmethylamino)-8-oxaspiro[4.5]decane-4-carbonitrile
CID 114244726
2-methyl-1-(methylamino)cyclohexane-1-carbonitrile
CID 43115025
1-(2-hydroxyethylamino)-2,2-dimethylcyclopentane-1-carbonitrile
CID 79856582
acetonitrile;N,1-dimethylcyclohexan-1-amine;ethane
CID 142051471
1-(tert-butylamino)cyclopentane-1-carbonitrile
CID 20825324
1-ethylcyclopentane-1-carbonitrile
CID 12859571
4-(methylamino)bicyclo[2.2.2]octane-1-carbonitrile
CID 137347137
4-bromospiro[4.4]nonane-4-carbonitrile
CID 130655931
2-methoxy-1-(methylamino)cyclohexane-1-carbonitrile
CID 106872820
1-cyano-N-(3-ethylpentan-3-yl)cyclopentane-1-carboxamide
CID 65043819
3-(methylamino)thiane-3-carbonitrile
CID 62872578

Frequently Asked Questions

What is the IUPAC name of 10-(methylamino)spiro[4.5]decane-10-carbonitrile?
The IUPAC name of 10-(methylamino)spiro[4.5]decane-10-carbonitrile (CID 130592844) is 10-(methylamino)spiro[4.5]decane-10-carbonitrile.
What is the SMILES notation for 10-(methylamino)spiro[4.5]decane-10-carbonitrile?
The canonical SMILES for 10-(methylamino)spiro[4.5]decane-10-carbonitrile is CNC1(C#N)CCCCC12CCCC2.
What is the InChIKey of 10-(methylamino)spiro[4.5]decane-10-carbonitrile?
The InChIKey is KZKFMRSCUFCVOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-14-12(10-13)9-5-4-8-11(12)6-2-3-7-11/h14H,2-9H2,1H3.
What are the key properties of 10-(methylamino)spiro[4.5]decane-10-carbonitrile?
10-(methylamino)spiro[4.5]decane-10-carbonitrile has a molecular weight of 192.31 g/mol, XLogP of 2.60, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(methylamino)spiro[4.5]decane-10-carbonitrile is sourced from PubChem (CID 130592844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).