CID 140659618

C13H20NO — CID 140659618

IUPAC—
SMILES[CH2]C(=O)CNC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C13H20NO/c1-9(15)8-14-13-5-10-2-11(6-13)4-12(3-10)7-13/h10-12,14H,1-8H2
InChIKeyHVBYOBXMHROZDL-UHFFFAOYSA-N
MW206.31 g/mol
LogP1.95
Rot. Bonds3

About CID 140659618

CID 140659618 (PubChem CID 140659618) has the molecular formula C13H20NO and a molecular weight of 206.31 g/mol.

Molecular Properties

Compound NameCID 140659618
PubChem CID140659618
Molecular FormulaC13H20NO
Molecular Weight206.31 g/mol
Exact Mass206.15
IUPAC Name—
SMILES[CH2]C(=O)CNC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C13H20NO/c1-9(15)8-14-13-5-10-2-11(6-13)4-12(3-10)7-13/h10-12,14H,1-8H2
InChIKeyHVBYOBXMHROZDL-UHFFFAOYSA-N
XLogP1.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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2-(1-adamantylamino)-N-(cyclopropylmethyl)acetamide
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2-(1-adamantylamino)-1-phenylethanone
CID 14291475
N-(2,3-dichloroprop-2-enyl)adamantan-1-amine
CID 79168192
2-(1-adamantylamino)-1-morpholin-4-ylethanone
CID 28567455
3-(1-adamantylamino)-2-aminopropanoic acid
CID 103231283
2-(1-adamantylamino)-N-(4-chlorophenyl)acetamide
CID 9032255
2-(1-adamantylamino)-1-(3,4-dimethylphenyl)ethanone
CID 82101287
2-(1-adamantylamino)-N-(3-chlorophenyl)acetamide
CID 9032168
2-(1-adamantylamino)-1-(3-aminophenyl)ethanone
CID 82258305

Frequently Asked Questions

What is the IUPAC name of CID 140659618?
The IUPAC name of CID 140659618 (CID 140659618) is not available.
What is the SMILES notation for CID 140659618?
The canonical SMILES for CID 140659618 is [CH2]C(=O)CNC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of CID 140659618?
The InChIKey is HVBYOBXMHROZDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20NO/c1-9(15)8-14-13-5-10-2-11(6-13)4-12(3-10)7-13/h10-12,14H,1-8H2.
What are the key properties of CID 140659618?
CID 140659618 has a molecular weight of 206.31 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 140659618 is sourced from PubChem (CID 140659618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).