[4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine

C14H19NSi — CID 174773540

IUPAC[4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine
SMILESCC1=C([SiH3])C(C)C=C1c1ccc(CN)cc1
InChIInChI=1S/C14H19NSi/c1-9-7-13(10(2)14(9)16)12-5-3-11(8-15)4-6-12/h3-7,9H,8,15H2,1-2,16H3
InChIKeyXZSBENWPPCVPPC-UHFFFAOYSA-N
MW229.40 g/mol
LogP1.82
Rot. Bonds2

About [4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine

[4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine (PubChem CID 174773540) has the molecular formula C14H19NSi and a molecular weight of 229.40 g/mol. Its IUPAC name is [4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine.

Molecular Properties

Compound Name[4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine
PubChem CID174773540
Molecular FormulaC14H19NSi
Molecular Weight229.40 g/mol
Exact Mass229.13
IUPAC Name[4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine
SMILESCC1=C([SiH3])C(C)C=C1c1ccc(CN)cc1
InChIInChI=1S/C14H19NSi/c1-9-7-13(10(2)14(9)16)12-5-3-11(8-15)4-6-12/h3-7,9H,8,15H2,1-2,16H3
InChIKeyXZSBENWPPCVPPC-UHFFFAOYSA-N
XLogP1.82
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.40
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[4-(2,4,5,5-tetramethyl-3-silylcyclopenta-1,3-dien-1-yl)phenyl]methanamine
CID 174657861
N-methylmethanamine;(4-methylphenyl)methanamine
CID 163390626
[4-(5-propan-2-yl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine
CID 174773769
[4-(4-ethylphenyl)phenyl]methanamine;hydrochloride
CID 178203189
[4-(3-bromo-2-methylphenyl)phenyl]methanamine
CID 140933850
[4-(1-methyltetrazol-5-yl)phenyl]methanamine
CID 82228462
[4-(bromomethyl)phenyl]methanamine
CID 24721042
[4-(1,5-dimethylpyrazol-4-yl)phenyl]methanamine
CID 66097207
(4-cyclopropyl-3-methylphenyl)methanamine
CID 66479429
[4-(5-methylcyclohexa-1,3-dien-1-yl)phenyl]methanamine
CID 146244829
[4-(5-methyl-1H-pyrazol-3-yl)phenyl]methanamine
CID 82468594
[4-[4-(2-methoxyethyl)phenyl]phenyl]methanamine
CID 61034030

Frequently Asked Questions

What is the IUPAC name of [4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine?
The IUPAC name of [4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine (CID 174773540) is [4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine.
What is the SMILES notation for [4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine?
The canonical SMILES for [4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine is CC1=C([SiH3])C(C)C=C1c1ccc(CN)cc1.
What is the InChIKey of [4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine?
The InChIKey is XZSBENWPPCVPPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NSi/c1-9-7-13(10(2)14(9)16)12-5-3-11(8-15)4-6-12/h3-7,9H,8,15H2,1-2,16H3.
What are the key properties of [4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine?
[4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine has a molecular weight of 229.40 g/mol, XLogP of 1.82, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3,5-dimethyl-4-silylcyclopenta-1,4-dien-1-yl)phenyl]methanamine is sourced from PubChem (CID 174773540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).