CID 59914822

C15H18N — CID 59914822

IUPAC—
SMILESC/N=C1\CCc2ccccc2C2[CH]CCC12
InChIInChI=1S/C15H18N/c1-16-15-10-9-11-5-2-3-6-12(11)13-7-4-8-14(13)15/h2-3,5-7,13-14H,4,8-10H2,1H3/b16-15+
InChIKeyKVJUTMGATLRDCQ-FOCLMDBBSA-N
MW212.32 g/mol
LogP3.40
Rot. Bonds

About CID 59914822

CID 59914822 (PubChem CID 59914822) has the molecular formula C15H18N and a molecular weight of 212.32 g/mol.

Molecular Properties

Compound NameCID 59914822
PubChem CID59914822
Molecular FormulaC15H18N
Molecular Weight212.32 g/mol
Exact Mass212.14
IUPAC Name—
SMILESC/N=C1\CCc2ccccc2C2[CH]CCC12
InChIInChI=1S/C15H18N/c1-16-15-10-9-11-5-2-3-6-12(11)13-7-4-8-14(13)15/h2-3,5-7,13-14H,4,8-10H2,1H3/b16-15+
InChIKeyKVJUTMGATLRDCQ-FOCLMDBBSA-N
XLogP3.40
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

[(E)-(1-methyl-3,4-dihydro-1H-naphthalen-2-ylidene)amino]urea
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3a,4,5,9b-tetrahydro-3H-cyclopenta[a]naphthalene
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2-ethenyltricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene
CID 168728590
2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethylazanium
CID 7009453
1,2,2a,3,4,8b-hexahydrocyclobuta[a]naphthalene
CID 156649341
2,3-dihydro-1H-inden-1-amine;methanamine
CID 174570832
[(1S)-2,3-dihydro-1H-inden-1-yl]-trimethylazanium
CID 57317290
tris(2,3-dihydro-1H-inden-1-ol);ethane
CID 19770523
1-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,4-dihydronaphthalene
CID 91351407
methyl tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene-2-carboxylate
CID 83985069
3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)propanenitrile
CID 10848103
(1S)-1-cyclopentyl-2,3-dihydro-1H-indene
CID 134946753

Frequently Asked Questions

What is the IUPAC name of CID 59914822?
The IUPAC name of CID 59914822 (CID 59914822) is not available.
What is the SMILES notation for CID 59914822?
The canonical SMILES for CID 59914822 is C/N=C1\CCc2ccccc2C2[CH]CCC12.
What is the InChIKey of CID 59914822?
The InChIKey is KVJUTMGATLRDCQ-FOCLMDBBSA-N. The full InChI is InChI=1S/C15H18N/c1-16-15-10-9-11-5-2-3-6-12(11)13-7-4-8-14(13)15/h2-3,5-7,13-14H,4,8-10H2,1H3/b16-15+.
What are the key properties of CID 59914822?
CID 59914822 has a molecular weight of 212.32 g/mol, XLogP of 3.40, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59914822 is sourced from PubChem (CID 59914822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).